bravais 0.2.0 → 0.3.0

package/dist/bravais.js

@@ -1,15 +1,29 @@
-import { ACESFilmicToneMapping as e, AlwaysStencilFunc as t, AmbientLight as n, Box3 as r, BoxGeometry as i, BufferGeometry as a, CanvasTexture as o, Color as s, ConeGeometry as c, Controls as l, CylinderGeometry as u, DataTexture as d, DirectionalLight as f, DoubleSide as p, EqualStencilFunc as m, Float32BufferAttribute as h, FloatType as g, Fog as ee, Group as _, InstancedMesh as v, LineBasicMaterial as y, LineSegments as b, LinearFilter as x, LinearMipmapLinearFilter as te, MOUSE as S, MathUtils as ne, Matrix4 as C, Mesh as w, MeshStandardMaterial as T, NearestFilter as E, NotEqualStencilFunc as D, Object3D as O, OrthographicCamera as k, PlaneGeometry as re, Quaternion as A, RGBAFormat as ie, ReplaceStencilOp as ae, SRGBColorSpace as oe, Scene as se, SphereGeometry as ce, Sprite as le, SpriteMaterial as ue, Vector2 as j, Vector3 as M, WebGLRenderer as N } from "three";
-//#region src/cif/tokenizer.ts
-var P = class extends Error {
+import { ACESFilmicToneMapping as e, AlwaysStencilFunc as t, AmbientLight as n, Box3 as r, BoxGeometry as i, BufferGeometry as a, CanvasTexture as o, Color as s, ConeGeometry as c, Controls as l, CylinderGeometry as u, DataTexture as d, DirectionalLight as f, DoubleSide as p, EqualStencilFunc as m, Float32BufferAttribute as h, FloatType as g, Fog as ee, Group as _, InstancedMesh as v, LineBasicMaterial as y, LineSegments as te, LinearFilter as ne, LinearMipmapLinearFilter as re, MOUSE as b, MathUtils as ie, Matrix4 as ae, Mesh as x, MeshStandardMaterial as S, NearestFilter as C, NotEqualStencilFunc as oe, Object3D as w, OrthographicCamera as T, PlaneGeometry as se, Quaternion as E, RGBAFormat as ce, ReplaceStencilOp as le, SRGBColorSpace as ue, Scene as de, SphereGeometry as fe, Sprite as pe, SpriteMaterial as me, Vector2 as D, Vector3 as O, WebGLRenderer as he } from "three";
+//#region src/structure/errors.ts
+var k = class extends Error {
+	constructor(e) {
+		super(e), this.name = "StructureError";
+	}
+}, A = class extends k {
+	constructor(e) {
+		super(e), this.name = "StructureDataError";
+	}
+}, j = class extends Error {
 	line;
 	constructor(e, t) {
 		super(`CIF line ${t}: ${e}`), this.name = "CifSyntaxError", this.line = t;
 	}
+}, M = class extends k {
+	constructor(e) {
+		super(e), this.name = "CifStructureError";
+	}
 };
-function F(e) {
+//#endregion
+//#region src/cif/tokenizer.ts
+function ge(e) {
 	return e === " " || e === "	" || e === "\r" || e === "\n";
 }
-function de(e, t) {
+function _e(e, t) {
 	let n = e.toLowerCase();
 	return e.startsWith("_") ? {
 		kind: "tag",
@@ -37,7 +51,7 @@ function de(e, t) {
 		line: t
 	};
 }
-function fe(e) {
+function ve(e) {
 	let t = [], n = e.split(/\r\n|\r|\n/), r = 0;
 	for (; r < n.length;) {
 		let e = n[r] ?? "", i = r + 1;
@@ -54,7 +68,7 @@ function fe(e) {
 				}
 				a.push(e), r += 1;
 			}
-			if (!o) throw new P("unterminated text field", i);
+			if (!o) throw new j("unterminated text field", i);
 			t.push({
 				kind: "value",
 				text: a.join("\n"),
@@ -65,7 +79,7 @@ function fe(e) {
 		let a = 0;
 		for (; a < e.length;) {
 			let n = e.charAt(a);
-			if (F(n)) {
+			if (ge(n)) {
 				a += 1;
 				continue;
 			}
@@ -74,15 +88,15 @@ function fe(e) {
 				let r = a + 1;
 				for (; r < e.length;) {
 					let t = e.indexOf(n, r);
-					if (t === -1) throw new P("unterminated quoted string", i);
+					if (t === -1) throw new j("unterminated quoted string", i);
 					let a = e.charAt(t + 1);
-					if (t + 1 >= e.length || F(a)) {
+					if (t + 1 >= e.length || ge(a)) {
 						r = t;
 						break;
 					}
 					r = t + 1;
 				}
-				if (r >= e.length) throw new P("unterminated quoted string", i);
+				if (r >= e.length) throw new j("unterminated quoted string", i);
 				t.push({
 					kind: "value",
 					text: e.slice(a + 1, r),
@@ -91,8 +105,8 @@ function fe(e) {
 				continue;
 			}
 			let r = a;
-			for (; r < e.length && !F(e.charAt(r));) r += 1;
-			t.push(de(e.slice(a, r), i)), a = r;
+			for (; r < e.length && !ge(e.charAt(r));) r += 1;
+			t.push(_e(e.slice(a, r), i)), a = r;
 		}
 		r += 1;
 	}
@@ -100,10 +114,10 @@ function fe(e) {
 }
 //#endregion
 //#region src/cif/parser.ts
-function pe(e) {
+function ye(e) {
 	return typeof e == "string" ? [e] : e;
 }
-var me = class {
+var be = class {
 	name;
 	items = /* @__PURE__ */ new Map();
 	loops = [];
@@ -111,41 +125,41 @@ var me = class {
 		this.name = e;
 	}
 	get(e) {
-		for (let t of pe(e)) {
+		for (let t of ye(e)) {
 			let e = this.items.get(t.toLowerCase());
 			if (e !== void 0) return e;
 		}
 		return null;
 	}
 	findLoop(e) {
-		for (let t of pe(e)) {
+		for (let t of ye(e)) {
 			let e = t.toLowerCase(), n = this.loops.find((t) => t.tags.includes(e));
 			if (n) return n;
 		}
 		return null;
 	}
 };
-function I(e, t) {
-	for (let n of pe(t)) {
+function N(e, t) {
+	for (let n of ye(t)) {
 		let t = e.tags.indexOf(n.toLowerCase());
 		if (t !== -1) return e.rows.map((e) => e[t] ?? "?");
 	}
 	return null;
 }
-function L(e) {
+function P(e) {
 	return e === "?" || e === ".";
 }
-function R(e) {
-	if (e == null || L(e)) return null;
+function F(e) {
+	if (e == null || P(e)) return null;
 	let t = e.replace(/\(\d+\)$/, "").trim();
 	return /^[+-]?(\d+\.?\d*|\.\d+)([eE][+-]?\d+)?$/.test(t) ? Number(t) : null;
 }
-function he(e) {
+function xe(e) {
 	return e === void 0 || e.kind !== "value";
 }
-function ge(e) {
-	let t = fe(e), n = [], r = null, i = 0, a = 0, o = (e) => {
-		if (r || (r = new me(""), n.push(r)), a > 0) throw new P(`unexpected ${e.kind} inside a save frame`, e.line);
+function Se(e) {
+	let t = ve(e), n = [], r = null, i = 0, a = 0, o = (e) => {
+		if (r || (r = new be(""), n.push(r)), a > 0) throw new j(`unexpected ${e.kind} inside a save frame`, e.line);
 		return r;
 	};
 	for (; i < t.length;) {
@@ -153,7 +167,7 @@ function ge(e) {
 		if (!e) break;
 		switch (e.kind) {
 			case "data":
-				r = new me(e.text), n.push(r), a = 0, i += 1;
+				r = new be(e.text), n.push(r), a = 0, i += 1;
 				break;
 			case "save":
 				a = e.text === "" ? Math.max(0, a - 1) : a + 1, i += 1;
@@ -167,18 +181,18 @@ function ge(e) {
 					break;
 				}
 				let n = o(e), r = t[i + 1];
-				if (!r || r.kind !== "value") throw new P(`tag ${e.text} has no value`, e.line);
+				if (!r || r.kind !== "value") throw new j(`tag ${e.text} has no value`, e.line);
 				n.items.set(e.text.toLowerCase(), r.text), i += 2;
 				break;
 			}
 			case "loop": {
 				let n = [];
 				for (i += 1; t[i]?.kind === "tag";) n.push(t[i].text.toLowerCase()), i += 1;
-				if (n.length === 0) throw new P("loop_ without tags", e.line);
+				if (n.length === 0) throw new j("loop_ without tags", e.line);
 				let r = [];
-				for (; !he(t[i]);) r.push(t[i].text), i += 1;
+				for (; !xe(t[i]);) r.push(t[i].text), i += 1;
 				if (a > 0) break;
-				if (r.length % n.length !== 0) throw new P(`loop with ${n.length} tags has ${r.length} values`, e.line);
+				if (r.length % n.length !== 0) throw new j(`loop with ${n.length} tags has ${r.length} values`, e.line);
 				let s = [];
 				for (let e = 0; e < r.length; e += n.length) s.push(r.slice(e, e + n.length));
 				o(e).loops.push({
@@ -187,103 +201,39 @@ function ge(e) {
 				});
 				break;
 			}
-			case "value": throw new P(`unexpected value ${JSON.stringify(e.text)}`, e.line);
+			case "value": throw new j(`unexpected value ${JSON.stringify(e.text)}`, e.line);
 		}
 	}
 	return { blocks: n };
 }
 //#endregion
 //#region src/structure/elements.ts
-var _e = /* @__PURE__ */ "H.He.Li.Be.B.C.N.O.F.Ne.Na.Mg.Al.Si.P.S.Cl.Ar.K.Ca.Sc.Ti.V.Cr.Mn.Fe.Co.Ni.Cu.Zn.Ga.Ge.As.Se.Br.Kr.Rb.Sr.Y.Zr.Nb.Mo.Tc.Ru.Rh.Pd.Ag.Cd.In.Sn.Sb.Te.I.Xe.Cs.Ba.La.Ce.Pr.Nd.Pm.Sm.Eu.Gd.Tb.Dy.Ho.Er.Tm.Yb.Lu.Hf.Ta.W.Re.Os.Ir.Pt.Au.Hg.Tl.Pb.Bi.Po.At.Rn.Fr.Ra.Ac.Th.Pa.U.Np.Pu.Am.Cm.Bk.Cf.Es.Fm.Md.No.Lr.Rf.Db.Sg.Bh.Hs.Mt.Ds.Rg.Cn.Nh.Fl.Mc.Lv.Ts.Og".split("."), ve = new Set(_e);
-function ye(e) {
-	return ve.has(e) || e === "D";
+var Ce = /* @__PURE__ */ "H.He.Li.Be.B.C.N.O.F.Ne.Na.Mg.Al.Si.P.S.Cl.Ar.K.Ca.Sc.Ti.V.Cr.Mn.Fe.Co.Ni.Cu.Zn.Ga.Ge.As.Se.Br.Kr.Rb.Sr.Y.Zr.Nb.Mo.Tc.Ru.Rh.Pd.Ag.Cd.In.Sn.Sb.Te.I.Xe.Cs.Ba.La.Ce.Pr.Nd.Pm.Sm.Eu.Gd.Tb.Dy.Ho.Er.Tm.Yb.Lu.Hf.Ta.W.Re.Os.Ir.Pt.Au.Hg.Tl.Pb.Bi.Po.At.Rn.Fr.Ra.Ac.Th.Pa.U.Np.Pu.Am.Cm.Bk.Cf.Es.Fm.Md.No.Lr.Rf.Db.Sg.Bh.Hs.Mt.Ds.Rg.Cn.Nh.Fl.Mc.Lv.Ts.Og".split("."), we = new Set(Ce), Te = "D";
+function Ee(e) {
+	return we.has(e) || e === Te;
 }
-function be(e) {
+function De(e) {
 	return e.charAt(0).toUpperCase() + e.slice(1).toLowerCase();
 }
-function xe(e) {
+function Oe(e) {
 	let t = e.match(/^[A-Za-z]{1,2}/)?.[0];
 	if (!t) return null;
-	let n = be(t);
-	if (t.length === 2 && ye(n)) return n;
+	let n = De(t);
+	if (t.length === 2 && Ee(n)) return n;
 	let r = t.charAt(0).toUpperCase();
-	return ye(r) ? r : null;
-}
-function Se(e) {
-	return e === "D" ? "H" : e;
-}
-//#endregion
-//#region src/structure/fractional.ts
-var Ce = .001, we = 1e-9;
-function z(e, t = we) {
-	let n = e - Math.floor(e);
-	return n >= 1 - t ? 0 : n;
-}
-function Te(e) {
-	return [
-		z(e[0]),
-		z(e[1]),
-		z(e[2])
-	];
-}
-function Ee(e, t, n) {
-	for (let r = 0; r < 3; r += 1) {
-		let i = Math.abs(e[r] - t[r]);
-		if (i -= Math.round(i), Math.abs(i) > n) return !1;
-	}
-	return !0;
-}
-var B = 100;
-function De(e) {
-	return Math.floor(z(e) * B) % B;
-}
-function Oe(e, t, n) {
-	return (e * B + t) * B + n;
+	return Ee(r) ? r : null;
 }
-var ke = class {
-	tolerance;
-	buckets = /* @__PURE__ */ new Map();
-	positions = [];
-	constructor(e) {
-		this.tolerance = e;
-	}
-	add(e) {
-		let t = this.positions.length;
-		this.positions.push(e);
-		let n = Oe(De(e[0]), De(e[1]), De(e[2])), r = this.buckets.get(n);
-		return r ? r.push(t) : this.buckets.set(n, [t]), t;
-	}
-	near(e) {
-		let t = Te(e), [n, r, i] = t.map(De), a = [];
-		for (let e = -1; e <= 1; e += 1) {
-			let o = (n + e + B) % B;
-			for (let e = -1; e <= 1; e += 1) {
-				let n = (r + e + B) % B;
-				for (let e = -1; e <= 1; e += 1) {
-					let r = (i + e + B) % B;
-					for (let e of this.buckets.get(Oe(o, n, r)) ?? []) Ee(this.positions[e], t, this.tolerance) && a.push(e);
-				}
-			}
-		}
-		return a.sort((e, t) => e - t);
-	}
-};
-function Ae(e, t) {
-	let n = e.rotation, [r, i, a] = t, o = e.translation;
-	return [
-		(n[0] ?? 0) * r + (n[1] ?? 0) * i + (n[2] ?? 0) * a + o[0],
-		(n[3] ?? 0) * r + (n[4] ?? 0) * i + (n[5] ?? 0) * a + o[1],
-		(n[6] ?? 0) * r + (n[7] ?? 0) * i + (n[8] ?? 0) * a + o[2]
-	];
+function ke(e) {
+	return e === Te ? "H" : e;
 }
 //#endregion
 //#region src/structure/lattice.ts
-var V = Math.PI / 180;
+var Ae = Math.PI / 180;
 function je(e, t, n) {
 	return Math.min(n, Math.max(t, e));
 }
 function Me(e) {
-	let { a: t, b: n, c: r } = e, i = e.alpha * V, a = e.beta * V, o = e.gamma * V, s = Math.cos(i), c = Math.cos(a), l = Math.cos(o), u = Math.sin(i), d = Math.sin(a), f = Math.acos(je((s * c - l) / (u * d), -1, 1)), p = [
+	let { a: t, b: n, c: r } = e, i = e.alpha * Ae, a = e.beta * Ae, o = e.gamma * Ae, s = Math.cos(i), c = Math.cos(a), l = Math.cos(o), u = Math.sin(i), d = Math.sin(a), f = Math.acos(je((s * c - l) / (u * d), -1, 1)), p = [
 		t * d,
 		0,
 		t * c
@@ -306,7 +256,7 @@ function Me(e) {
 	};
 }
 function Ne(e) {
-	let [t, n, r] = e, i = (e) => Math.hypot(e[0], e[1], e[2]), a = (e, t) => Math.acos(je((e[0] * t[0] + e[1] * t[1] + e[2] * t[2]) / (i(e) * i(t)), -1, 1)) / V;
+	let [t, n, r] = e, i = (e) => Math.hypot(e[0], e[1], e[2]), a = (e, t) => Math.acos(je((e[0] * t[0] + e[1] * t[1] + e[2] * t[2]) / (i(e) * i(t)), -1, 1)) / Ae;
 	return {
 		a: i(t),
 		b: i(n),
@@ -330,44 +280,139 @@ function Fe(e, t) {
 	return Math.sqrt(n * n + r * r + i * i);
 }
 //#endregion
-//#region src/cif/errors.ts
-var H = class extends Error {
+//#region src/structure/fractional.ts
+var Ie = .001, Le = 1e-9;
+function I(e, t = Le) {
+	let n = e - Math.floor(e);
+	return n >= 1 - t ? 0 : n;
+}
+function Re(e) {
+	return [
+		I(e[0]),
+		I(e[1]),
+		I(e[2])
+	];
+}
+function ze(e, t, n) {
+	for (let r = 0; r < 3; r += 1) {
+		let i = Math.abs(e[r] - t[r]);
+		if (i -= Math.round(i), Math.abs(i) > n) return !1;
+	}
+	return !0;
+}
+var L = 100;
+function Be(e) {
+	return Math.floor(I(e) * L) % L;
+}
+function Ve(e, t, n) {
+	return (e * L + t) * L + n;
+}
+var He = class {
+	tolerance;
+	buckets = /* @__PURE__ */ new Map();
+	positions = [];
 	constructor(e) {
-		super(e), this.name = "CifStructureError";
+		this.tolerance = e;
+	}
+	add(e) {
+		let t = this.positions.length;
+		this.positions.push(e);
+		let n = Ve(Be(e[0]), Be(e[1]), Be(e[2])), r = this.buckets.get(n);
+		return r ? r.push(t) : this.buckets.set(n, [t]), t;
+	}
+	near(e) {
+		let t = Re(e), [n, r, i] = t.map(Be), a = [];
+		for (let e = -1; e <= 1; e += 1) {
+			let o = (n + e + L) % L;
+			for (let e = -1; e <= 1; e += 1) {
+				let n = (r + e + L) % L;
+				for (let e = -1; e <= 1; e += 1) {
+					let r = (i + e + L) % L;
+					for (let e of this.buckets.get(Ve(o, n, r)) ?? []) ze(this.positions[e], t, this.tolerance) && a.push(e);
+				}
+			}
+		}
+		return a.sort((e, t) => e - t);
+	}
+};
+function Ue(e, t) {
+	let n = e.rotation, [r, i, a] = t, o = e.translation;
+	return [
+		(n[0] ?? 0) * r + (n[1] ?? 0) * i + (n[2] ?? 0) * a + o[0],
+		(n[3] ?? 0) * r + (n[4] ?? 0) * i + (n[5] ?? 0) * a + o[1],
+		(n[6] ?? 0) * r + (n[7] ?? 0) * i + (n[8] ?? 0) * a + o[2]
+	];
+}
+//#endregion
+//#region src/structure/sites.ts
+var We = 1e-4;
+function Ge(e, t, n) {
+	let r = e.find((e) => e.element === t);
+	r ? r.occupancy += n : e.push({
+		element: t,
+		occupancy: n
+	}), e.sort((e, t) => t.occupancy - e.occupancy);
+}
+function Ke(e) {
+	for (let t of e) {
+		let e = t.species.reduce((e, t) => e + t.occupancy, 0);
+		if (e > 1.000001) for (let n of t.species) n.occupancy /= e;
+	}
+}
+function qe(e) {
+	let t = [], n = new He(We);
+	for (let r of e) {
+		let e = [
+			I(r.fractional[0]),
+			I(r.fractional[1]),
+			I(r.fractional[2])
+		], [i] = n.near(e);
+		i === void 0 ? (n.add(e), t.push({
+			label: r.label,
+			species: [{
+				element: r.element,
+				occupancy: r.occupancy
+			}],
+			fractional: e
+		})) : Ge(t[i].species, r.element, r.occupancy);
 	}
-}, Ie = [
+	return Ke(t), t;
+}
+//#endregion
+//#region src/cif/symmetry-operations.ts
+var Je = [
 	"x",
 	"y",
 	"z"
 ];
-function Le(e) {
+function Ye(e) {
 	if (e === "" || e === "+") return 1;
 	if (e === "-") return -1;
 	let t = e.match(/^([+-]?\d+)\/(\d+)$/), n = t ? Number(t[1]) / Number(t[2]) : Number(e);
-	if (!Number.isFinite(n)) throw new H(`Cannot read the number ${JSON.stringify(e)} in a symmetry operator.`);
+	if (!Number.isFinite(n)) throw new M(`Cannot read the number ${JSON.stringify(e)} in a symmetry operation.`);
 	return n;
 }
-function Re(e) {
+function Xe(e) {
 	let t = e.split(",").map((e) => e.toLowerCase().replace(/[^xyz0-9./+-]/g, ""));
-	if (t.length !== 3) throw new H(`A symmetry operator needs three components: ${JSON.stringify(e)}.`);
+	if (t.length !== 3) throw new M(`A symmetry operation needs three components: ${JSON.stringify(e)}.`);
 	let n = [], r = [];
 	for (let i of t) {
 		let t = i.match(/[+-]?[^+-]+/g);
-		if (!t || t.join("") !== i) throw new H(`Cannot read the symmetry operator ${JSON.stringify(e)}.`);
+		if (!t || t.join("") !== i) throw new M(`Cannot read the symmetry operation ${JSON.stringify(e)}.`);
 		let a = [
 			0,
 			0,
 			0
 		], o = 0;
 		for (let e of t) {
-			let t = Ie.findIndex((t) => e.includes(t));
-			if (t === -1) o += Le(e);
+			let t = Je.findIndex((t) => e.includes(t));
+			if (t === -1) o += Ye(e);
 			else {
-				let n = Le(e.replace(Ie[t], "").replace(/\*$/, ""));
+				let n = Ye(e.replace(Je[t], "").replace(/\*$/, ""));
 				a[t] = (a[t] ?? 0) + n;
 			}
 		}
-		n.push(...a), r.push(z(o));
+		n.push(...a), r.push(I(o));
 	}
 	return {
 		rotation: n,
@@ -376,99 +421,85 @@ function Re(e) {
 }
 //#endregion
 //#region src/cif/structure.ts
-var ze = 1e-4, Be = ["_space_group_symop_operation_xyz", "_symmetry_equiv_pos_as_xyz"], Ve = ["_space_group_it_number", "_symmetry_int_tables_number"], He = [
+var Ze = ["_space_group_symop_operation_xyz", "_symmetry_equiv_pos_as_xyz"], Qe = ["_space_group_it_number", "_symmetry_int_tables_number"], $e = [
 	"_space_group_name_h-m_alt",
 	"_symmetry_space_group_name_h-m",
 	"_space_group_name_h-m_full"
-], Ue = ["_space_group_name_hall", "_symmetry_space_group_name_hall"];
-function U(e, t) {
-	let n = R(e.get(t));
-	if (n === null) throw new H(`${e.name || "The CIF"} has no usable ${t}.`);
+], et = ["_space_group_name_hall", "_symmetry_space_group_name_hall"];
+function R(e, t) {
+	let n = F(e.get(t));
+	if (n === null) throw new M(`${e.name || "The CIF"} has no usable ${t}.`);
 	return n;
 }
-function We(e, t, n) {
-	let r = e.find((e) => e.element === t);
-	r ? r.occupancy += n : e.push({
-		element: t,
-		occupancy: n
-	}), e.sort((e, t) => t.occupancy - e.occupancy);
-}
-function Ge(e) {
-	for (let t of e) {
-		let e = t.species.reduce((e, t) => e + t.occupancy, 0);
-		if (e > 1.000001) for (let n of t.species) n.occupancy /= e;
-	}
-}
-function Ke(e) {
+function tt(e) {
 	let t = e.findLoop("_atom_site_fract_x");
-	if (!t) throw new H(`${e.name || "The CIF"} has no atom sites.`);
-	let n = I(t, "_atom_site_fract_x") ?? [], r = I(t, "_atom_site_fract_y") ?? [], i = I(t, "_atom_site_fract_z") ?? [], a = I(t, "_atom_site_label"), o = I(t, "_atom_site_type_symbol"), s = I(t, "_atom_site_occupancy"), c = [], l = new ke(ze);
+	if (!t) throw new M(`${e.name || "The CIF"} has no atom sites.`);
+	let n = N(t, "_atom_site_fract_x") ?? [], r = N(t, "_atom_site_fract_y") ?? [], i = N(t, "_atom_site_fract_z") ?? [], a = N(t, "_atom_site_label"), o = N(t, "_atom_site_type_symbol"), s = N(t, "_atom_site_occupancy"), c = [];
 	for (let e = 0; e < t.rows.length; e += 1) {
-		let t = R(n[e]), u = R(r[e]), d = R(i[e]);
-		if (t === null || u === null || d === null) continue;
-		let f = a?.[e] ?? o?.[e] ?? `site${e + 1}`, p = o?.[e], m = (p && !L(p) ? xe(p) : null) ?? xe(f);
-		if (!m) throw new H(`Atom site ${JSON.stringify(f)} names no element (type symbol ${JSON.stringify(p ?? "")}).`);
-		let h = R(s?.[e]) ?? 1, g = [
-			z(t),
-			z(u),
-			z(d)
-		], [ee] = l.near(g);
-		ee === void 0 ? (l.add(g), c.push({
-			label: f,
-			species: [{
-				element: m,
-				occupancy: h
-			}],
-			fractional: g
-		})) : We(c[ee].species, m, h);
+		let t = F(n[e]), l = F(r[e]), u = F(i[e]);
+		if (t === null || l === null || u === null) continue;
+		let d = a?.[e] ?? o?.[e] ?? `site${e + 1}`, f = o?.[e], p = (f && !P(f) ? Oe(f) : null) ?? Oe(d);
+		if (!p) throw new M(`Atom site ${JSON.stringify(d)} names no element (type symbol ${JSON.stringify(f ?? "")}).`);
+		let m = F(s?.[e]) ?? 1;
+		c.push({
+			label: d,
+			element: p,
+			occupancy: m,
+			fractional: [
+				t,
+				l,
+				u
+			]
+		});
 	}
-	if (c.length === 0) throw new H(`${e.name || "The CIF"} has no atom sites with coordinates.`);
-	return Ge(c), c;
+	let l = qe(c);
+	if (l.length === 0) throw new M(`${e.name || "The CIF"} has no atom sites with coordinates.`);
+	return l;
 }
-function qe(e) {
-	let t = e.findLoop(Be);
+function nt(e) {
+	let t = e.findLoop(Ze);
 	if (!t) {
-		let t = e.get(Be);
-		return t === null ? null : [Re(t)];
+		let t = e.get(Ze);
+		return t === null ? null : [Xe(t)];
 	}
-	let n = (I(t, Be) ?? []).filter((e) => !L(e)).map(Re);
+	let n = (N(t, Ze) ?? []).filter((e) => !P(e)).map(Xe);
 	return n.length > 0 ? n : null;
 }
-function Je(e) {
-	let t = e.get(Ve), n = t === null ? null : R(t), r = e.get(He), i = e.get(Ue);
+function rt(e) {
+	let t = F(e.get(Qe)), n = e.get($e), r = e.get(et);
 	return {
-		number: n !== null && Number.isInteger(n) && n >= 1 && n <= 230 ? n : null,
-		symbol: r !== null && !L(r) ? r.trim() : null,
-		hallSymbol: i !== null && !L(i) ? i.trim() : null
+		number: t !== null && Number.isInteger(t) && t >= 1 && t <= 230 ? t : null,
+		symbol: n !== null && !P(n) ? n.trim() : null,
+		hallSymbol: r !== null && !P(r) ? r.trim() : null
 	};
 }
-function Ye(e) {
+function it(e) {
 	return e.findLoop("_atom_site_fract_x") !== null;
 }
-function Xe(e) {
+function at(e) {
 	return {
 		lattice: Me({
-			a: U(e, "_cell_length_a"),
-			b: U(e, "_cell_length_b"),
-			c: U(e, "_cell_length_c"),
-			alpha: U(e, "_cell_angle_alpha"),
-			beta: U(e, "_cell_angle_beta"),
-			gamma: U(e, "_cell_angle_gamma")
+			a: R(e, "_cell_length_a"),
+			b: R(e, "_cell_length_b"),
+			c: R(e, "_cell_length_c"),
+			alpha: R(e, "_cell_angle_alpha"),
+			beta: R(e, "_cell_angle_beta"),
+			gamma: R(e, "_cell_angle_gamma")
 		}),
-		sites: Ke(e),
-		operations: qe(e),
-		spaceGroup: Je(e)
+		sites: tt(e),
+		operations: nt(e),
+		spaceGroup: rt(e)
 	};
 }
 //#endregion
 //#region src/structure/closure.ts
-function Ze(e, t) {
-	let n = new ke(Ce);
+function ot(e, t) {
+	let n = new He(Ie);
 	for (let t of e) n.add(t.fractional);
 	let r = !1, i = !0;
 	return e.forEach((e, a) => {
 		for (let o of t) {
-			let t = n.near(Ae(o, e.fractional));
+			let t = n.near(Ue(o, e.fractional));
 			t.some((e) => e !== a) && (r = !0), t.length === 0 && (i = !1);
 		}
 	}), {
@@ -478,7 +509,7 @@ function Ze(e, t) {
 }
 //#endregion
 //#region src/structure/types.ts
-var Qe = {
+var st = {
 	rotation: [
 		1,
 		0,
@@ -495,29 +526,29 @@ var Qe = {
 		0,
 		0
 	]
-}, $e = null, et = null;
-function tt() {
-	return et ||= import("./moyo-wasm.js").then(async (e) => {
-		await e.instantiate(), $e = e;
+}, ct = null, lt = null;
+function ut() {
+	return lt ||= import("./moyo-wasm.js").then(async (e) => {
+		await e.instantiate(), ct = e;
 	}).catch((e) => {
-		throw et = null, e;
-	}), et;
+		throw lt = null, e;
+	}), lt;
 }
-function W() {
-	if (!$e) throw Error("moyo is not loaded yet; await ensureMoyo() first.");
-	return $e;
+function dt() {
+	if (!ct) throw Error("moyo is not loaded yet; await ensureMoyo() first.");
+	return ct;
 }
 //#endregion
 //#region src/symmetry/moyo.ts
-var nt = class extends Error {
+var ft = class extends Error {
 	constructor(e) {
 		super(e), this.name = "SpaceGroupLookupError";
 	}
-}, G = null;
-function rt() {
-	return tt();
+}, z = null;
+function pt() {
+	return ut();
 }
-function it(e) {
+function mt(e) {
 	let t = e.rotation;
 	return {
 		rotation: [
@@ -538,119 +569,282 @@ function it(e) {
 		]
 	};
 }
-function at() {
-	if (!G) {
-		G = [];
-		for (let e = 1; e <= 230; e += 1) G.push(...W().hall_symbol_entries_from_number(e));
+function ht() {
+	if (!z) {
+		z = [];
+		for (let e = 1; e <= 230; e += 1) z.push(...dt().hall_symbol_entries_from_number(e));
 	}
-	return G;
+	return z;
 }
-function K(e) {
+function B(e) {
 	return e.replace(/[\s_]/g, "").toLowerCase();
 }
-function ot(e) {
+function gt(e) {
 	let t = e.trim(), n = t.match(/^(.*?)\s*:\s*(\S+)$/);
 	if (n && n[1] && n[2]) return {
-		base: K(n[1]),
+		base: B(n[1]),
 		setting: n[2].toLowerCase()
 	};
 	let r = t.match(/^(.*\S)\s+([HRhr])$/);
 	return r && r[1] && r[2] ? {
-		base: K(r[1]),
+		base: B(r[1]),
 		setting: r[2].toLowerCase()
 	} : {
-		base: K(t),
+		base: B(t),
 		setting: null
 	};
 }
-function st(e) {
+function _t(e) {
 	let t = e[0];
 	if (!t) return e;
-	let n = W().space_group_type(t.number).hall_number;
+	let n = dt().space_group_type(t.number).hall_number;
 	return [...e].sort((e, t) => Number(t.hall_number === n) - Number(e.hall_number === n));
 }
-function ct(e) {
-	let t = at().filter((t) => e.number === null || t.number === e.number);
+function vt(e) {
+	let t = ht().filter((t) => e.number === null || t.number === e.number);
 	if (e.hallSymbol) {
-		let n = K(e.hallSymbol), r = t.filter((e) => K(e.hall_symbol) === n);
+		let n = B(e.hallSymbol), r = t.filter((e) => B(e.hall_symbol) === n);
 		if (r.length > 0) return r;
 	}
 	if (e.symbol) {
-		let { base: n, setting: r } = ot(e.symbol), i = t.filter((e) => K(e.hm_short) === n || K(e.hm_full) === n);
+		let { base: n, setting: r } = gt(e.symbol), i = t.filter((e) => B(e.hm_short) === n || B(e.hm_full) === n);
 		if (r) {
 			let e = i.filter((e) => e.setting.toLowerCase() === r);
 			if (e.length > 0) return e;
 		}
-		return st(i);
+		return _t(i);
 	}
 	return [];
 }
-function lt(e) {
+function yt(e) {
 	return [
 		e.hallSymbol,
 		e.symbol,
 		e.number
 	].filter((e) => e !== null).join(" / ");
 }
-async function ut(e) {
-	await rt();
-	let { operations_from_number: t } = W();
+async function bt(e) {
+	await pt();
+	let { operations_from_number: t } = dt();
 	if (e.hallSymbol || e.symbol) {
-		let n = ct(e);
-		if (n.length === 0) throw new nt(`Space group ${lt(e)} is not in the symmetry table.`);
+		let n = vt(e);
+		if (n.length === 0) throw new ft(`Space group ${yt(e)} is not in the symmetry table.`);
 		return n.map((e) => ({
 			setting: e.setting,
 			operations: t(e.number, {
 				type: "HallNumber",
 				value: e.hall_number
-			}, !1).map(it)
+			}, !1).map(mt)
 		}));
 	}
-	if (e.number === null) throw new nt("The CIF names no space group.");
+	if (e.number === null) throw new ft("No space group is named.");
 	return [{
 		setting: "",
-		operations: t(e.number, { type: "Spglib" }, !1).map(it)
+		operations: t(e.number, { type: "Spglib" }, !1).map(mt)
 	}];
 }
-async function dt(e) {
-	let [t] = await ut(e);
+async function xt(e) {
+	let [t] = await bt(e);
 	return t.operations;
 }
 //#endregion
 //#region src/symmetry/resolve.ts
-var ft = .001, pt = .01;
-function mt() {
-	return new H("The symmetry does not fit the listed atoms: they are already expanded, yet the operations generate positions the file does not list.");
+var St = .001, Ct = .01;
+function wt(e) {
+	return new e("The symmetry does not fit the listed atoms: they are already expanded, yet the operations generate positions that are not listed.");
 }
-function ht(e, t) {
-	let n = Ze(e, t);
-	if (n.preExpanded && !n.closed) throw mt();
+function Tt(e, t, n) {
+	let r = ot(e, t);
+	if (r.preExpanded && !r.closed) throw wt(n);
 }
-function gt({ a: e, b: t, c: n, alpha: r, beta: i, gamma: a }) {
-	let o = (e, t) => Math.abs(e - t) <= ft * Math.max(e, t), s = (e, t) => Math.abs(e - t) <= pt;
+function Et({ a: e, b: t, c: n, alpha: r, beta: i, gamma: a }) {
+	let o = (e, t) => Math.abs(e - t) <= St * Math.max(e, t), s = (e, t) => Math.abs(e - t) <= Ct;
 	return o(e, t) && o(t, n) && s(r, i) && s(i, a) && !s(r, 90) ? "R" : o(e, t) && s(r, 90) && s(i, 90) && s(a, 120) ? "H" : null;
 }
-async function _t(e) {
-	if (e.operations) return ht(e.sites, e.operations), e.operations;
-	let { spaceGroup: t } = e;
-	if (t.hallSymbol === null && t.symbol === null && t.number === null) return [Qe];
-	let n = await ut(t);
-	if (n.length === 1) {
-		let [t] = n;
-		return ht(e.sites, t.operations), t.operations;
-	}
-	let r = n.map((t) => Ze(e.sites, t.operations)), i = n.find((e, t) => r[t].preExpanded && r[t].closed);
-	if (i) return i.operations;
-	if (r.some((e) => e.preExpanded)) throw mt();
-	let a = gt(e.lattice);
-	return ((a === null ? void 0 : n.find((e) => e.setting.toUpperCase() === a)) ?? n[0]).operations;
+async function Dt(e, t) {
+	if (e.operations) return Tt(e.sites, e.operations, t), e.operations;
+	let { spaceGroup: n } = e;
+	if (n.hallSymbol === null && n.symbol === null && n.number === null) return [st];
+	let r = await bt(n);
+	if (r.length === 1) {
+		let [n] = r;
+		return Tt(e.sites, n.operations, t), n.operations;
+	}
+	let i = r.map((t) => ot(e.sites, t.operations)), a = r.find((e, t) => i[t].preExpanded && i[t].closed);
+	if (a) return a.operations;
+	if (i.some((e) => e.preExpanded)) throw wt(t);
+	let o = Et(e.lattice);
+	return ((o === null ? void 0 : r.find((e) => e.setting.toUpperCase() === o)) ?? r[0]).operations;
+}
+//#endregion
+//#region src/structure/from-data.ts
+var Ot = 1e-9, kt = 1e-6;
+function V(e) {
+	throw new A(e);
+}
+function H(e) {
+	return typeof e == "object" && !!e && !Array.isArray(e);
+}
+function U(e) {
+	return e === void 0 ? "undefined" : typeof e == "object" && e ? Array.isArray(e) ? "an array" : "an object" : JSON.stringify(e) ?? String(e);
+}
+function W(e, t) {
+	return (typeof e != "number" || !Number.isFinite(e)) && V(`${t} must be a finite number, not ${U(e)}.`), e;
+}
+function G(e, t) {
+	let n = W(e, t);
+	return n <= 0 && V(`${t} must be positive, not ${n}.`), n;
+}
+function K(e, t) {
+	let n = Array.isArray(e) || ArrayBuffer.isView(e) ? Array.from(e) : null;
+	return (n === null || n.length !== 3) && V(`${t} must hold three numbers, not ${U(e)}.`), [
+		W(n[0], `${t}[0]`),
+		W(n[1], `${t}[1]`),
+		W(n[2], `${t}[2]`)
+	];
+}
+function At([e, t, n]) {
+	return e[0] * (t[1] * n[2] - t[2] * n[1]) - e[1] * (t[0] * n[2] - t[2] * n[0]) + e[2] * (t[0] * n[1] - t[1] * n[0]);
+}
+function jt(e) {
+	if (H(e) || V("lattice must be an object with a, b, c, alpha, beta and gamma, or with vectors."), e.vectors !== void 0 && e.vectors !== null) {
+		let t = e.vectors;
+		(!Array.isArray(t) || t.length !== 3) && V(`lattice.vectors must be three vectors, not ${U(t)}.`);
+		let n = [
+			K(t[0], "lattice.vectors[0]"),
+			K(t[1], "lattice.vectors[1]"),
+			K(t[2], "lattice.vectors[2]")
+		];
+		return Math.abs(At(n)) < kt && V("lattice.vectors lie in one plane: the cell has no volume."), Ne(n);
+	}
+	let t = {
+		a: G(e.a, "lattice.a"),
+		b: G(e.b, "lattice.b"),
+		c: G(e.c, "lattice.c"),
+		alpha: G(e.alpha, "lattice.alpha"),
+		beta: G(e.beta, "lattice.beta"),
+		gamma: G(e.gamma, "lattice.gamma")
+	}, n = Me(t);
+	return Math.abs(At(n.vectors)) >= kt || V(`lattice angles ${t.alpha}, ${t.beta} and ${t.gamma} degrees do not form a cell.`), n;
+}
+function Mt(e) {
+	(!Array.isArray(e) || e.length === 0) && V(`sites must be a non-empty array, not ${U(e)}.`);
+	let t = [];
+	return e.forEach((e, n) => {
+		let r = `sites[${n}]`;
+		H(e) || V(`${r} must be an object, not ${U(e)}.`);
+		let i = e.label;
+		i != null && typeof i != "string" && V(`${r}.label must be a string, not ${U(i)}.`);
+		let a = i ?? `site${n + 1}`, o = K(e.fractional, `${r}.fractional`), s = e.species;
+		(!Array.isArray(s) || s.length === 0) && V(`${r}.species must be a non-empty array, not ${U(s)}.`), s.forEach((e, n) => {
+			let i = `${r}.species[${n}]`;
+			H(e) || V(`${i} must be an object, not ${U(e)}.`);
+			let s = e.element;
+			(typeof s != "string" || !Ee(s)) && V(`${i}.element must be an element symbol such as "Fe", or "D", not ${U(s)}.`);
+			let c = e.occupancy, l = c == null ? 1 : W(c, `${i}.occupancy`);
+			l < 0 && V(`${i}.occupancy must not be negative, not ${l}.`), t.push({
+				label: a,
+				element: s,
+				occupancy: l,
+				fractional: o
+			});
+		});
+	}), t;
+}
+function Nt(e) {
+	return Math.abs(e - Math.round(e)) <= Ot;
+}
+function Pt(e) {
+	return e.rotation.every((e, t) => Math.abs(e - +(t % 4 == 0)) <= Ot) && e.translation.every((e) => Nt(e));
+}
+function Ft(e, t) {
+	let n = Array.isArray(e) || ArrayBuffer.isView(e) ? Array.from(e) : null;
+	(n === null || n.length !== 9) && V(`${t} must hold nine numbers, row by row, not ${U(e)}.`);
+	let r = n.map((e, n) => W(e, `${t}[${n}]`));
+	r.every(Nt) || V(`${t} must hold whole numbers.`);
+	let i = [
+		[
+			r[0],
+			r[1],
+			r[2]
+		],
+		[
+			r[3],
+			r[4],
+			r[5]
+		],
+		[
+			r[6],
+			r[7],
+			r[8]
+		]
+	];
+	return Math.abs(Math.abs(At(i)) - 1) > Ot && V(`${t} must have determinant 1 or -1.`), r.map(Math.round);
+}
+function It(e, t) {
+	if (typeof e == "string") {
+		let n;
+		try {
+			n = Xe(e);
+		} catch (e) {
+			V(`${t}: ${e instanceof Error ? e.message : String(e)}`);
+		}
+		return {
+			rotation: Ft(n.rotation, `${t} (${e})`),
+			translation: n.translation
+		};
+	}
+	return H(e) || V(`${t} must be a string such as "x, y, z" or an object with rotation and translation, not ${U(e)}.`), {
+		rotation: Ft(e.rotation, `${t}.rotation`),
+		translation: Re(K(e.translation, `${t}.translation`))
+	};
+}
+function Lt(e) {
+	if (e == null) return null;
+	(!Array.isArray(e) || e.length === 0) && V(`operations must be a non-empty array, or absent, not ${U(e)}.`);
+	let t = e.map((e, t) => It(e, `operations[${t}]`));
+	return t.some(Pt) || V("operations must include the identity, x, y, z."), t;
+}
+function Rt(e) {
+	if (e == null) return {
+		number: null,
+		symbol: null,
+		hallSymbol: null
+	};
+	H(e) || V(`spaceGroup must be an object with number, symbol or hallSymbol, not ${U(e)}.`);
+	let t = e.number;
+	t != null && !(typeof t == "number" && Number.isInteger(t) && t >= 1 && t <= 230) && V(`spaceGroup.number must be a whole number from 1 to 230, not ${U(t)}.`);
+	let n = (t) => {
+		let n = e[t];
+		return n == null ? null : ((typeof n != "string" || n.trim() === "") && V(`spaceGroup.${t} must be a non-empty string, not ${U(n)}.`), n.trim());
+	};
+	return {
+		number: t ?? null,
+		symbol: n("symbol"),
+		hallSymbol: n("hallSymbol")
+	};
+}
+async function zt(e) {
+	H(e) || V(`Structure data must be an object, not ${U(e)}.`);
+	let t = jt(e.lattice), n = qe(Mt(e.sites)), r = Rt(e.spaceGroup);
+	return {
+		lattice: t,
+		sites: n,
+		operations: await Dt({
+			lattice: t,
+			sites: n,
+			operations: Lt(e.operations),
+			spaceGroup: r
+		}, A),
+		spaceGroup: r
+	};
 }
 //#endregion
 //#region src/structure/expand.ts
-function vt(e) {
-	let t = [], n = new ke(Ce);
+function Bt(e) {
+	let t = [], n = new He(Ie);
 	for (let r of e.sites) for (let i of e.operations) {
-		let e = Te(Ae(i, r.fractional));
+		let e = Re(Ue(i, r.fractional));
 		n.near(e).length === 0 && (n.add(e), t.push({
 			label: r.label,
 			species: r.species,
@@ -660,17 +854,17 @@ function vt(e) {
 	return {
 		...e,
 		sites: t,
-		operations: [Qe]
+		operations: [st]
 	};
 }
 //#endregion
 //#region src/symmetry/dataset.ts
-var yt = .01, bt = class extends Error {
+var Vt = .01, Ht = class extends Error {
 	constructor(e) {
 		super(e), this.name = "SymmetryAnalysisError";
 	}
 };
-function xt(e) {
+function Ut(e) {
 	let t = /* @__PURE__ */ new Map(), n = /* @__PURE__ */ new Map();
 	return {
 		numbers: e.map((e) => {
@@ -680,7 +874,7 @@ function xt(e) {
 		speciesByLabel: n
 	};
 }
-function St(e, t, n) {
+function Wt(e, t, n) {
 	let r = e.std_cell.lattice.basis, i = [
 		[
 			r[0],
@@ -702,13 +896,13 @@ function St(e, t, n) {
 		return a.set(s, c), {
 			label: `${s}${c}`,
 			species: o,
-			fractional: Te(n)
+			fractional: Re(n)
 		};
 	});
 	return {
 		lattice: Ne(i),
 		sites: o,
-		operations: [Qe],
+		operations: [st],
 		spaceGroup: {
 			number: e.number,
 			symbol: e.hm_symbol,
@@ -716,9 +910,9 @@ function St(e, t, n) {
 		}
 	};
 }
-async function Ct(e, t = {}) {
-	await rt();
-	let { analyze_cell: n, hall_symbol_entry: r, space_group_type: i } = W(), a = vt(e), { numbers: o, speciesByLabel: s } = xt(a.sites), [c, l, u] = a.lattice.vectors, d = {
+async function Gt(e, t = {}) {
+	await pt();
+	let { analyze_cell: n, hall_symbol_entry: r, space_group_type: i } = dt(), a = Bt(e), { numbers: o, speciesByLabel: s } = Ut(a.sites), [c, l, u] = a.lattice.vectors, d = {
 		lattice: { basis: [
 			...c,
 			...l,
@@ -728,11 +922,11 @@ async function Ct(e, t = {}) {
 		numbers: o
 	}, f;
 	try {
-		f = n(JSON.stringify(d), t.symprec ?? yt, "Standard");
+		f = n(JSON.stringify(d), t.symprec ?? Vt, "Standard");
 	} catch (e) {
-		throw new bt(`moyo could not analyse the structure: ${e instanceof Error ? e.message : String(e)}`);
+		throw new Ht(`moyo could not analyse the structure: ${e instanceof Error ? e.message : String(e)}`);
 	}
-	let p = r(f.hall_number), m = i(f.number), h = St(f, s, p);
+	let p = r(f.hall_number), m = i(f.number), h = Wt(f, s, p);
 	return {
 		number: f.number,
 		symbol: f.hm_symbol,
@@ -741,7 +935,7 @@ async function Ct(e, t = {}) {
 		hallNumber: f.hall_number,
 		setting: p.setting,
 		crystalSystem: m.crystal_system,
-		operations: f.operations.map(it),
+		operations: f.operations.map(mt),
 		wyckoffs: f.wyckoffs,
 		siteSymmetries: f.site_symmetry_symbols,
 		structure: a,
@@ -750,34 +944,34 @@ async function Ct(e, t = {}) {
 }
 //#endregion
 //#region src/symmetry/symbol.ts
-var wt = "₀₁₂₃₄₅₆₇₈₉", Tt = "̅";
-function Et(e) {
-	return wt[Number(e)] ?? e;
+var Kt = "₀₁₂₃₄₅₆₇₈₉", qt = "̅";
+function Jt(e) {
+	return Kt[Number(e)] ?? e;
 }
-function Dt(e) {
+function Yt(e) {
 	let t = e.trim(), n = t.indexOf(":"), r = n === -1 ? t : t.slice(0, n).trim(), i = n === -1 ? "" : ` ${t.slice(n)}`, a = r.split(/\s+/);
-	return a.map((e) => a.length > 1 ? e.replace(/^([2346])([1-5])(?=$|\/)/, (e, t, n) => Number(n) < Number(t) ? t + Et(n) : e) : e).join("").replace(/(\d)_(\d)/g, (e, t, n) => t + Et(n)).replace(/-(\d)/g, (e, t) => t + Tt) + i;
+	return a.map((e) => a.length > 1 ? e.replace(/^([2346])([1-5])(?=$|\/)/, (e, t, n) => Number(n) < Number(t) ? t + Jt(n) : e) : e).join("").replace(/(\d)_(\d)/g, (e, t, n) => t + Jt(n)).replace(/-(\d)/g, (e, t) => t + qt) + i;
 }
 //#endregion
 //#region src/structure/bonds.ts
-var Ot = {
+var Xt = {
 	source: "VESTA bond-search cutoffs (K. Momma and F. Izumi), as distributed in pymatgen's vesta_cutoffs.yaml (MIT). Where VESTA lists a pair twice (H-O, D-O), the shorter cutoff is kept.",
 	pairs: /* @__PURE__ */ JSON.parse("{\"Ac-Br\":3.22726,\"Ac-Cl\":3.08646,\"Ac-F\":2.58646,\"Ac-O\":2.7326,\"Ag-As\":2.45642,\"Ag-Br\":2.37642,\"Ag-Cl\":3.05939,\"Ag-F\":2.76939,\"Ag-H\":1.65642,\"Ag-I\":2.53642,\"Ag-N\":2.00642,\"Ag-O\":2.81139,\"Ag-P\":2.37642,\"Ag-S\":3.08839,\"Ag-Se\":2.41642,\"Ag-Te\":2.66642,\"Al-As\":2.75646,\"Al-Br\":2.65646,\"Al-Cl\":2.48846,\"Al-F\":2.00146,\"Al-H\":1.90646,\"Al-I\":2.86646,\"Al-N\":2.24646,\"Al-O\":2.1074,\"Al-P\":2.69646,\"Al-S\":2.66646,\"Al-Se\":2.72646,\"Al-Te\":2.93646,\"Am-Br\":3.22944,\"Am-Cl\":3.08945,\"Am-F\":2.61945,\"Am-O\":2.71649,\"As-Au\":2.26998,\"As-B\":2.42646,\"As-Ba\":3.69,\"As-Be\":2.60649,\"As-Bi\":2.87642,\"As-Br\":2.80646,\"As-C\":2.38646,\"As-Ca\":3.48295,\"As-Cd\":3.29295,\"As-Ce\":3.08644,\"As-Cl\":2.61646,\"As-Co\":2.43642,\"As-Cr\":2.49642,\"As-Cs\":4.15942,\"As-Cu\":2.71895,\"As-Dy\":3.14,\"As-Er\":3.18,\"As-Eu\":2.93898,\"As-F\":2.15646,\"As-Fe\":2.50642,\"As-Ga\":2.38998,\"As-Gd\":3.18,\"As-Ge\":2.47998,\"As-Hf\":2.71642,\"As-Hg\":2.65642,\"As-Ho\":2.87898,\"As-I\":3.03646,\"As-In\":2.66642,\"As-Ir\":2.58998,\"As-K\":3.94942,\"As-La\":3.51293,\"As-Lu\":3.19649,\"As-Mg\":3.09293,\"As-Mn\":2.51642,\"As-Mo\":2.62701,\"As-Na\":3.64942,\"As-Nb\":2.69642,\"As-Ni\":2.28998,\"As-O\":2.24546,\"As-P\":2.29998,\"As-Pb\":3.02644,\"As-Pd\":2.34998,\"As-Pr\":3.35649,\"As-Pt\":2.30998,\"As-Rb\":4.04645,\"As-Re\":2.61998,\"As-Rh\":2.41998,\"As-Ru\":2.40998,\"As-S\":2.84649,\"As-Sb\":2.64998,\"As-Sc\":3.04291,\"As-Se\":2.98649,\"As-Si\":2.66002,\"As-Sm\":3.30649,\"As-Sn\":2.77642,\"As-Sr\":3.62295,\"As-Ta\":2.70642,\"As-Tb\":3.26649,\"As-Te\":3.10646,\"As-Th\":3.40649,\"As-Ti\":2.87642,\"As-Tl\":3.09644,\"As-Tm\":3.22649,\"As-U\":3.02644,\"As-V\":2.54642,\"As-W\":2.58998,\"As-Y\":3.24649,\"As-Yb\":3.19649,\"As-Zn\":2.95293,\"As-Zr\":3.07004,\"Au-Br\":2.77646,\"Au-Cl\":2.88295,\"Au-F\":2.34646,\"Au-H\":1.41998,\"Au-I\":3.21295,\"Au-N\":2.3826,\"Au-O\":2.34646,\"Au-P\":2.18998,\"Au-S\":2.8326,\"Au-Se\":2.22998,\"Au-Te\":2.45998,\"B-B\":1.85846,\"B-Br\":2.33646,\"B-Cl\":2.19646,\"B-F\":1.76646,\"B-H\":1.59646,\"B-I\":2.55646,\"B-N\":1.93846,\"B-O\":1.82746,\"B-P\":2.37646,\"B-S\":2.27646,\"B-Se\":2.40646,\"B-Te\":2.65646,\"Ba-Br\":3.74295,\"Ba-Cl\":3.55295,\"Ba-F\":3.05095,\"Ba-H\":3.08295,\"Ba-I\":3.99295,\"Ba-N\":3.33295,\"Ba-O\":3.14795,\"Ba-P\":3.48295,\"Ba-S\":3.66195,\"Ba-Se\":3.74295,\"Ba-Te\":3.94295,\"Be-Br\":2.50649,\"Be-Cl\":2.36649,\"Be-F\":1.88749,\"Be-H\":1.71649,\"Be-I\":2.70649,\"Be-N\":2.10649,\"Be-O\":1.98749,\"Be-P\":2.55649,\"Be-S\":2.43649,\"Be-Se\":2.57649,\"Be-Te\":2.81649,\"Bi-Br\":3.17993,\"Bi-Cl\":3.04291,\"Bi-F\":2.55291,\"Bi-H\":2.12642,\"Bi-I\":3.38291,\"Bi-N\":2.56329,\"Bi-O\":2.6608,\"Bi-P\":2.78642,\"Bi-S\":3.13291,\"Bi-Se\":3.24329,\"Bi-Te\":3.02642,\"Bk-Br\":3.15233,\"Bk-Cl\":3.02291,\"Bk-F\":2.54233,\"Bk-O\":2.64329,\"Br-C\":2.26002,\"Br-Ca\":3.36995,\"Br-Cd\":3.21295,\"Br-Ce\":3.40452,\"Br-Cf\":3.14233,\"Br-Cl\":2.33296,\"Br-Co\":2.33642,\"Br-Cr\":2.97293,\"Br-Cs\":4.06942,\"Br-Cu\":2.89295,\"Br-Dy\":3.16945,\"Br-Er\":3.14945,\"Br-Eu\":3.46549,\"Br-F\":2.20646,\"Br-Fe\":2.8952,\"Br-Ga\":2.6426,\"Br-Gd\":3.19945,\"Br-Ge\":2.34998,\"Br-Hf\":2.62642,\"Br-Hg\":3.09293,\"Br-Ho\":3.20159,\"Br-In\":3.05329,\"Br-Ir\":2.49998,\"Br-K\":3.8513,\"Br-La\":3.43293,\"Br-Li\":3.11654,\"Br-Lu\":3.11945,\"Br-Mg\":2.99293,\"Br-Mn\":3.05293,\"Br-Mo\":2.8535,\"Br-Na\":3.57715,\"Br-Nb\":3.07646,\"Br-Nd\":3.37293,\"Br-Ni\":2.80649,\"Br-Np\":3.21233,\"Br-O\":2.35646,\"Br-Os\":2.72002,\"Br-P\":2.44293,\"Br-Pa\":3.18437,\"Br-Pb\":3.62451,\"Br-Pd\":2.80649,\"Br-Pm\":3.18233,\"Br-Pr\":3.27649,\"Br-Pt\":2.94191,\"Br-Pu\":3.19233,\"Br-Rb\":4.05498,\"Br-Re\":2.70002,\"Br-Rh\":2.7126,\"Br-Ru\":2.30998,\"Br-S\":2.21998,\"Br-Sb\":2.96646,\"Br-Sc\":2.94291,\"Br-Se\":2.78002,\"Br-Si\":2.55002,\"Br-Sm\":3.26649,\"Br-Sn\":3.2152,\"Br-Sr\":3.54295,\"Br-Ta\":2.60642,\"Br-Tb\":3.18649,\"Br-Te\":2.90002,\"Br-Th\":3.31945,\"Br-Ti\":3.20293,\"Br-Tl\":3.80942,\"Br-Tm\":3.13945,\"Br-U\":3.39452,\"Br-V\":2.87329,\"Br-W\":2.49998,\"Br-Y\":3.15649,\"Br-Yb\":3.12945,\"Br-Zn\":2.86293,\"Br-Zr\":2.98004,\"C-C\":1.89002,\"C-Cl\":2.11002,\"C-Co\":2.19691,\"C-Cu\":2.32649,\"C-F\":1.76002,\"C-Fe\":2.25191,\"C-H\":1.2,\"C-I\":2.16998,\"C-N\":1.79202,\"C-O\":1.97249,\"C-P\":1.93998,\"C-Pd\":2.33649,\"C-Pt\":2.36649,\"C-S\":2.15002,\"C-Se\":2.01998,\"C-Si\":2.23302,\"C-Te\":2.25998,\"Ca-Cl\":3.23295,\"Ca-F\":2.70495,\"Ca-H\":2.69295,\"Ca-I\":3.58295,\"Ca-N\":3.00295,\"Ca-O\":2.83062,\"Ca-P\":3.41295,\"Ca-S\":3.31295,\"Ca-Se\":3.42295,\"Ca-Te\":3.62295,\"Cd-Cl\":3.09295,\"Cd-F\":2.67395,\"Cd-H\":2.52295,\"Cd-I\":3.46295,\"Cd-N\":2.82295,\"Cd-O\":2.76695,\"Cd-P\":3.20295,\"Cd-S\":3.16695,\"Cd-Se\":3.26295,\"Cd-Te\":3.45295,\"Ce-Cl\":3.25293,\"Ce-F\":2.75452,\"Ce-H\":2.34644,\"Ce-I\":3.62452,\"Ce-N\":2.78549,\"Ce-O\":2.86393,\"Ce-P\":3.00644,\"Ce-S\":3.36293,\"Ce-Se\":3.04644,\"Ce-Te\":3.22644,\"Cf-Cl\":3.01291,\"Cf-F\":2.53233,\"Cf-O\":2.63291,\"Cl-Cl\":2.14296,\"Cl-Cm\":3.18291,\"Cl-Co\":2.74593,\"Cl-Cr\":2.80293,\"Cl-Cs\":3.91042,\"Cl-Cu\":2.75295,\"Cl-D\":1.5,\"Cl-Dy\":3.01945,\"Cl-Er\":2.99944,\"Cl-Eu\":3.32549,\"Cl-F\":2.14646,\"Cl-Fe\":2.86293,\"Cl-Ga\":2.52646,\"Cl-Gd\":3.06349,\"Cl-Ge\":2.49002,\"Cl-H\":1.5,\"Cl-Hf\":2.75646,\"Cl-Hg\":3.24939,\"Cl-Ho\":3.05159,\"Cl-I\":3.33295,\"Cl-In\":3.52939,\"Cl-Ir\":2.56746,\"Cl-K\":3.65976,\"Cl-La\":3.33452,\"Cl-Li\":2.91814,\"Cl-Lu\":2.96944,\"Cl-Mg\":2.79293,\"Cl-Mn\":2.84593,\"Cl-Mo\":2.80447,\"Cl-N\":2.20646,\"Cl-NH\":3.48195,\"Cl-Na\":3.39412,\"Cl-Nb\":2.76291,\"Cl-Nd\":3.22493,\"Cl-Ni\":2.62649,\"Cl-Np\":3.07233,\"Cl-O\":2.16646,\"Cl-Os\":2.54002,\"Cl-P\":2.28746,\"Cl-Pa\":3.01437,\"Cl-Pb\":3.39295,\"Cl-Pd\":2.65649,\"Cl-Pm\":3.41233,\"Cl-Pr\":3.12749,\"Cl-Pt\":2.75646,\"Cl-Pu\":3.05233,\"Cl-Rb\":3.86664,\"Cl-Re\":3.44712,\"Cl-Rh\":2.62646,\"Cl-Ru\":2.70646,\"Cl-S\":2.37002,\"Cl-Sb\":2.80646,\"Cl-Sc\":2.92291,\"Cl-Se\":2.57002,\"Cl-Si\":2.38002,\"Cl-Sm\":3.08749,\"Cl-Sn\":3.13111,\"Cl-Sr\":3.37295,\"Cl-Ta\":2.6739,\"Cl-Tb\":3.04349,\"Cl-Tc\":2.56002,\"Cl-Te\":2.73906,\"Cl-Th\":3.15945,\"Cl-Ti\":3.02293,\"Cl-Tl\":3.72942,\"Cl-Tm\":2.98944,\"Cl-U\":3.24452,\"Cl-V\":3.15293,\"Cl-W\":2.47,\"Cl-Y\":3.00649,\"Cl-Yb\":2.98249,\"Cl-Zn\":2.72293,\"Cl-Zr\":3.33651,\"Cm-F\":2.68291,\"Cm-O\":2.79291,\"Co-F\":2.35293,\"Co-H\":1.9278,\"Co-I\":2.52878,\"Co-In\":3.13629,\"Co-N\":2.36293,\"Co-O\":2.40493,\"Co-P\":2.36642,\"Co-S\":2.65293,\"Co-Se\":2.39642,\"Co-Te\":2.61642,\"Cr-F\":2.45293,\"Cr-H\":1.67642,\"Cr-I\":3.19293,\"Cr-N\":2.5152,\"Cr-O\":2.44293,\"Cr-P\":2.42642,\"Cr-S\":2.72491,\"Cr-Se\":2.44642,\"Cr-Te\":2.67642,\"Cs-F\":3.49942,\"Cs-H\":3.55942,\"Cs-I\":4.40942,\"Cs-N\":3.94942,\"Cs-O\":3.53642,\"Cs-P\":3.64194,\"Cs-S\":4.24942,\"Cs-Se\":4.21655,\"Cs-Te\":4.4631,\"Cu-F\":2.46295,\"Cu-H\":1.81649,\"Cu-I\":3.01795,\"Cu-N\":2.49295,\"Cu-O\":2.47295,\"Cu-P\":2.65649,\"Cu-S\":2.76095,\"Cu-Se\":2.76295,\"Cu-Te\":2.87649,\"D-F\":1.1,\"D-N\":1.2,\"D-O\":1.2,\"Dy-F\":2.52944,\"Dy-H\":2.09,\"Dy-I\":3.39945,\"Dy-N\":2.38,\"Dy-O\":2.65651,\"Dy-P\":2.77,\"Dy-S\":2.823,\"Dy-Se\":2.81,\"Dy-Te\":3.22,\"Er-F\":2.51049,\"Er-H\":2.06,\"Er-I\":3.38945,\"Er-N\":2.36,\"Er-O\":2.63651,\"Er-P\":2.75,\"Er-S\":3.27651,\"Er-Se\":3.18649,\"Er-Te\":3.22,\"Es-O\":2.70139,\"Eu-F\":2.83549,\"Eu-H\":2.18898,\"Eu-I\":3.69549,\"Eu-N\":2.95549,\"Eu-O\":2.94249,\"Eu-P\":2.85898,\"Eu-S\":3.37949,\"Eu-Se\":2.89898,\"Eu-Te\":3.08898,\"F-Fe\":2.36293,\"F-Ga\":2.14646,\"F-Gd\":3.15651,\"F-Ge\":2.01002,\"F-H\":1.1,\"F-Hf\":3.18291,\"F-Hg\":2.88293,\"F-Ho\":2.56159,\"F-I\":3.18295,\"F-In\":2.35491,\"F-Ir\":2.15002,\"F-K\":3.11142,\"F-Kr\":2.67549,\"F-La\":2.79293,\"F-Li\":2.34276,\"F-Lu\":2.48249,\"F-Mg\":2.29093,\"F-Mn\":2.41093,\"F-Mo\":2.2998,\"F-N\":1.82646,\"F-NH\":2.99195,\"F-Na\":2.80398,\"F-Nb\":2.35646,\"F-Nd\":2.73452,\"F-Ni\":2.20249,\"F-Np\":2.59233,\"F-Os\":2.07746,\"F-P\":2.01002,\"F-Pa\":2.54437,\"F-Pb\":2.92045,\"F-Pd\":2.34649,\"F-Pm\":2.55233,\"F-Po\":2.83646,\"F-Pr\":2.62945,\"F-Pt\":2.54002,\"F-Pu\":2.58233,\"F-Rb\":3.37645,\"F-Re\":2.16002,\"F-Rh\":2.16646,\"F-Ru\":2.57646,\"F-S\":1.95002,\"F-Sb\":2.35646,\"F-Sc\":2.32291,\"F-Se\":2.08002,\"F-Si\":1.93002,\"F-Sm\":2.60649,\"F-Sn\":2.63793,\"F-Sr\":2.88195,\"F-Ta\":2.2539,\"F-Tb\":2.54249,\"F-Tc\":2.24219,\"F-Te\":2.22002,\"F-Th\":2.68945,\"F-Ti\":2.86293,\"F-Tl\":3.26942,\"F-Tm\":2.51649,\"F-U\":2.80293,\"F-V\":2.87293,\"F-W\":2.03,\"F-Xe\":2.62649,\"F-Y\":2.51049,\"F-Yb\":2.50649,\"F-Zn\":2.38293,\"F-Zr\":2.99651,\"Fe-H\":1.68642,\"Fe-I\":3.1552,\"Fe-N\":2.48193,\"Fe-O\":2.44693,\"Fe-P\":2.42642,\"Fe-S\":2.83793,\"Fe-Se\":2.43642,\"Fe-Te\":2.68642,\"Ga-H\":1.55998,\"Ga-I\":2.91646,\"Ga-N\":1.96,\"Ga-O\":2.18646,\"Ga-P\":2.46998,\"Ga-S\":2.61946,\"Ga-Se\":3.41295,\"Ga-Te\":2.58998,\"Gd-H\":2.13,\"Gd-I\":3.41945,\"Gd-N\":2.42,\"Gd-O\":2.76651,\"Gd-P\":2.81,\"Gd-S\":3.13649,\"Gd-Se\":2.85,\"Gd-Te\":3.24,\"Ge-Ge\":2.6,\"Ge-H\":1.59998,\"Ge-I\":2.54998,\"Ge-N\":1.92998,\"Ge-O\":2.09802,\"Ge-P\":2.36998,\"Ge-S\":2.56702,\"Ge-Se\":2.70002,\"Ge-Te\":2.60998,\"H-Hf\":1.93642,\"H-Hg\":1.86642,\"H-Ho\":2.11898,\"H-In\":1.87642,\"H-Ir\":1.80998,\"H-K\":3.21942,\"H-La\":2.77293,\"H-Lu\":2.42649,\"H-Mg\":2.24293,\"H-Mn\":1.70642,\"H-Mo\":1.83701,\"H-N\":1.2,\"H-Na\":2.79942,\"H-Nb\":1.90642,\"H-Ni\":1.44998,\"H-O\":1.2,\"H-P\":1.45998,\"H-Pb\":2.27644,\"H-Pd\":1.51998,\"H-Pr\":2.62649,\"H-Pt\":1.44998,\"H-Rb\":3.43645,\"H-Re\":1.79998,\"H-Rh\":1.59998,\"H-Ru\":1.65998,\"H-S\":1.42998,\"H-Sb\":2.81998,\"H-Sc\":2.24291,\"H-Se\":1.58998,\"H-Si\":1.82002,\"H-Sm\":2.56649,\"H-Sn\":2.00642,\"H-Sr\":2.87295,\"H-Ta\":1.91642,\"H-Tb\":2.51649,\"H-Te\":1.87998,\"H-Th\":2.67649,\"H-Ti\":1.76642,\"H-Tl\":2.35644,\"H-Tm\":2.45649,\"H-U\":2.27644,\"H-V\":1.73642,\"H-W\":1.80998,\"H-Y\":2.46649,\"H-Yb\":2.42649,\"H-Zn\":2.13293,\"H-Zr\":2.29004,\"Hf-I\":2.83642,\"Hf-N\":2.24642,\"Hf-O\":2.37946,\"Hf-P\":2.63642,\"Hf-S\":2.64642,\"Hf-Se\":2.67642,\"Hf-Te\":2.87642,\"Hg-Hg\":3.1952,\"Hg-I\":3.33293,\"Hg-N\":2.17642,\"Hg-O\":2.86939,\"Hg-P\":2.57642,\"Hg-S\":3.42093,\"Hg-Se\":2.82642,\"Hg-Te\":2.76642,\"Ho-I\":3.44159,\"Ho-N\":2.41898,\"Ho-O\":2.67047,\"Ho-P\":2.79898,\"Ho-S\":3.13547,\"Ho-Se\":2.84898,\"Ho-Te\":3.03898,\"I-I\":2.4,\"I-In\":3.19291,\"I-Ir\":2.70998,\"I-K\":4.11717,\"I-La\":3.64293,\"I-Li\":3.37676,\"I-Lu\":3.36945,\"I-Mg\":3.17293,\"I-Mn\":3.23293,\"I-Mo\":2.74701,\"I-Na\":3.88251,\"I-Nb\":3.1439,\"I-Nd\":3.59452,\"I-Ni\":3.00649,\"I-Np\":3.44233,\"I-O\":2.47646,\"I-P\":2.44998,\"I-Pb\":3.69562,\"I-Pd\":2.96649,\"I-Pr\":3.49649,\"I-Pt\":2.41998,\"I-Pu\":3.43233,\"I-Rb\":4.33462,\"I-Re\":2.65998,\"I-Rh\":2.52998,\"I-Ru\":2.52998,\"I-S\":2.40998,\"I-Sb\":3.21646,\"I-Sc\":3.15291,\"I-Se\":2.58998,\"I-Si\":2.76002,\"I-Sm\":3.44649,\"I-Sn\":3.52293,\"I-Sr\":3.74295,\"I-Ta\":2.81642,\"I-Tb\":3.40945,\"I-Te\":3.13702,\"I-Th\":3.56649,\"I-Ti\":3.08291,\"I-Tl\":3.94142,\"I-Tm\":3.37945,\"I-U\":3.62452,\"I-V\":2.66642,\"I-W\":2.70998,\"I-Y\":3.37649,\"I-Yb\":3.37945,\"I-Zn\":3.07293,\"I-Zr\":3.19004,\"In-Mn\":3.14729,\"In-N\":2.18642,\"In-O\":2.46491,\"In-P\":2.68642,\"In-S\":2.93291,\"In-Se\":2.62642,\"In-Te\":2.84642,\"Ir-N\":2.10998,\"Ir-O\":2.27746,\"Ir-P\":2.50998,\"Ir-S\":2.42998,\"Ir-Se\":2.55998,\"Ir-Te\":2.75998,\"K-N\":3.41942,\"K-O\":3.25142,\"K-P\":3.44942,\"K-S\":3.79285,\"K-Se\":4.00186,\"K-Te\":4.23284,\"La-N\":3.05293,\"La-O\":2.90983,\"La-P\":3.32293,\"La-S\":3.35593,\"La-Se\":3.45293,\"La-Te\":3.65293,\"Li-N\":2.66213,\"Li-O\":2.60087,\"Li-S\":3.02481,\"Li-Se\":3.2433,\"Li-Te\":3.42496,\"Lu-N\":2.71649,\"Lu-O\":2.57749,\"Lu-P\":3.11649,\"Lu-S\":3.03649,\"Lu-Se\":3.16649,\"Lu-Te\":3.35649,\"Mg-N\":2.56293,\"Mg-O\":2.41824,\"Mg-P\":3.00293,\"Mg-S\":2.89293,\"Mg-Se\":3.03293,\"Mg-Te\":3.24293,\"Mn-N\":2.56193,\"Mn-O\":2.51652,\"Mn-P\":2.39642,\"Mn-S\":2.93293,\"Mn-Se\":2.47642,\"Mn-Te\":2.70642,\"Mo-N\":2.4735,\"Mo-O\":2.3475,\"Mo-P\":2.54701,\"Mo-S\":2.80067,\"Mo-Se\":2.59701,\"Mo-Te\":2.79701,\"N-N\":1.8826,\"N-Na\":3.12942,\"N-Nb\":2.46046,\"N-Nd\":3.01293,\"N-Ni\":2.30649,\"N-O\":1.81746,\"N-P\":1.97146,\"N-Pb\":3.0967,\"N-Pd\":2.40451,\"N-Pr\":2.90649,\"N-Pt\":2.41649,\"N-Rb\":3.79645,\"N-Re\":2.10998,\"N-Rh\":2.2626,\"N-Ru\":2.2626,\"N-S\":2.28849,\"N-Sb\":2.56446,\"N-Sc\":2.54291,\"N-Se\":2.1,\"N-Si\":2.12002,\"N-Sm\":3.02351,\"N-Sn\":2.7152,\"N-Sr\":3.09295,\"N-Ta\":2.16642,\"N-Tb\":2.80649,\"N-Te\":2.16998,\"N-Th\":2.94649,\"N-Ti\":2.08642,\"N-Tl\":2.59644,\"N-Tm\":2.74649,\"N-U\":2.78649,\"N-V\":2.38329,\"N-W\":2.10998,\"N-Y\":2.77649,\"N-Yb\":2.84851,\"N-Zn\":2.43293,\"N-Zr\":2.65004,\"NH-O\":3.08895,\"Na-O\":2.95693,\"Na-P\":3.47942,\"Na-S\":3.57685,\"Na-Se\":3.71593,\"Na-Te\":3.95459,\"Nb-O\":2.45329,\"Nb-P\":2.61642,\"Nb-S\":2.74,\"Nb-Se\":2.66642,\"Nb-Te\":2.85642,\"Nd-O\":2.8587,\"Nd-S\":3.42712,\"Nd-Se\":3.42293,\"Nd-Te\":3.60293,\"Ni-O\":2.28149,\"Ni-P\":2.31998,\"Ni-S\":2.58649,\"Ni-Se\":2.18998,\"Ni-Te\":2.47998,\"Np-O\":2.63646,\"Np-S\":3.2,\"O-O\":1.7,\"O-Os\":2.23,\"O-P\":2.08646,\"O-Pa\":2.63383,\"O-Pb\":3.04096,\"O-Pd\":2.39849,\"O-Po\":2.64646,\"O-Pr\":2.74449,\"O-Pt\":2.40649,\"O-Pu\":2.68329,\"O-Rb\":3.43945,\"O-Re\":2.3426,\"O-Rh\":2.24946,\"O-Ru\":2.22646,\"O-S\":1.8,\"O-Sb\":2.45237,\"O-Sc\":2.42029,\"O-Se\":2.16102,\"O-Si\":1.99002,\"O-Sm\":2.88251,\"O-Sn\":2.82146,\"O-Sr\":2.98095,\"O-Ta\":2.74646,\"O-Tb\":2.65549,\"O-Tc\":2.22446,\"O-Te\":2.3334,\"O-Th\":2.77349,\"O-Ti\":2.35391,\"O-Tl\":3.36945,\"O-Tm\":2.60649,\"O-U\":2.94295,\"O-V\":2.84939,\"O-W\":2.20102,\"O-Xe\":2.63451,\"O-Y\":2.62549,\"O-Yb\":2.74551,\"O-Zn\":2.41693,\"O-Zr\":3.09651,\"Os-S\":2.56002,\"P-P\":2.48381,\"P-Pb\":2.94644,\"P-Pd\":2.46998,\"P-Pr\":3.28649,\"P-Pt\":2.23998,\"P-Rb\":3.50645,\"P-Re\":2.50998,\"P-Rh\":2.43998,\"P-Ru\":2.33998,\"P-S\":2.57646,\"P-Sb\":2.56998,\"P-Sc\":2.96291,\"P-Se\":2.69646,\"P-Si\":2.58002,\"P-Sm\":3.23649,\"P-Sn\":2.60642,\"P-Sr\":3.43295,\"P-Ta\":2.62642,\"P-Tb\":3.19649,\"P-Te\":2.56998,\"P-Th\":3.33649,\"P-Ti\":2.51642,\"P-Tl\":3.01644,\"P-Tm\":3.13649,\"P-U\":2.94644,\"P-V\":2.46642,\"P-W\":2.50998,\"P-Y\":3.17649,\"P-Yb\":3.13649,\"P-Zn\":2.86293,\"P-Zr\":3.02004,\"Pb-S\":3.40395,\"Pb-Se\":3.55295,\"Pb-Te\":3.14644,\"Pd-S\":2.69649,\"Pd-Se\":2.26998,\"Pd-Te\":2.52998,\"Pr-S\":3.20649,\"Pr-Se\":3.32649,\"Pr-Te\":3.50649,\"Pt-S\":2.76649,\"Pt-Se\":2.23998,\"Pt-Te\":2.49998,\"Pu-S\":3.3,\"Rb-S\":3.97645,\"Rb-Se\":4.13773,\"Rb-Te\":4.28802,\"Re-S\":2.61998,\"Re-Se\":2.54998,\"Re-Te\":2.74998,\"Rh-S\":2.19998,\"Rh-Se\":2.37998,\"Rh-Te\":2.59998,\"Ru-S\":2.6426,\"Ru-Se\":2.69451,\"Ru-Te\":2.58998,\"S-S\":2.2,\"S-Sb\":3.05,\"S-Sc\":2.88391,\"S-Se\":2.81649,\"S-Si\":2.47602,\"S-Sm\":3.15649,\"S-Sn\":3.15293,\"S-Sr\":3.51295,\"S-Ta\":2.8439,\"S-Tb\":3.11649,\"S-Te\":2.79002,\"S-Th\":3.24649,\"S-Ti\":2.74646,\"S-Tl\":3.66442,\"S-Tm\":3.05649,\"S-U\":3.25293,\"S-V\":2.82293,\"S-W\":2.43998,\"S-Y\":3.08649,\"S-Yb\":3.03649,\"S-Zn\":2.80293,\"S-Zr\":2.91004,\"Sb-Se\":3.05646,\"Sb-Te\":2.82998,\"Sc-Se\":3.00291,\"Sc-Te\":3.20291,\"Se-Se\":2.93649,\"Se-Si\":2.61002,\"Se-Sm\":3.27649,\"Se-Sn\":2.96646,\"Se-Sr\":3.58295,\"Se-Ta\":2.66642,\"Se-Tb\":3.23649,\"Se-Te\":2.57998,\"Se-Th\":3.36649,\"Se-Ti\":2.53642,\"Se-Tl\":3.00644,\"Se-Tm\":3.18649,\"Se-U\":3.00644,\"Se-V\":2.48642,\"Se-W\":2.55998,\"Se-Y\":3.21649,\"Se-Yb\":3.16649,\"Se-Zn\":2.93293,\"Se-Zr\":3.03004,\"Si-Si\":2.6,\"Si-Te\":2.84002,\"Sm-Te\":3.46649,\"Sn-Te\":2.91642,\"Sr-Te\":3.73295,\"Ta-Te\":2.85642,\"Tb-Te\":3.42649,\"Te-Te\":2.80998,\"Te-Th\":3.54649,\"Te-Ti\":2.95642,\"Te-Tl\":3.23644,\"Te-Tm\":3.37649,\"Te-U\":3.16644,\"Te-V\":2.72642,\"Te-W\":2.75998,\"Te-Y\":3.40649,\"Te-Yb\":3.36649,\"Te-Zn\":3.16293,\"Te-Zr\":3.17004}")
-}.pairs, kt = .4;
-function At(e, t) {
-	return Ot[e < t ? `${e}-${t}` : `${t}-${e}`] ?? null;
+}.pairs, Zt = .4;
+function Qt(e, t) {
+	return Xt[e < t ? `${e}-${t}` : `${t}-${e}`] ?? null;
 }
-function jt(e) {
+function $t(e) {
 	let t = /* @__PURE__ */ new Map(), n = e.map((e) => {
 		let n = t.get(e.element);
 		return n === void 0 && (n = t.size, t.set(e.element, n)), n;
 	}), r = [...t.keys()], i = new Float64Array(r.length * r.length), a = 0;
 	if (r.forEach((e, t) => {
 		r.forEach((n, o) => {
-			let s = At(e, n) ?? 0;
+			let s = Qt(e, n) ?? 0;
 			i[t * r.length + o] = s, a = Math.max(a, s);
 		});
-	}), a < kt) return [];
+	}), a < Zt) return [];
 	let o = e.map((e) => e.position.map((e) => Math.floor(e / a) | 0)), s = [
 		Infinity,
 		Infinity,
@@ -799,9 +993,9 @@ function jt(e) {
 		m.length = 0;
 		for (let r = -1; r <= 1; r += 1) for (let o = -1; o <= 1; o += 1) for (let p = -1; p <= 1; p += 1) for (let h of f.get(d(s + r, c + o, l + p)) ?? []) {
 			let r = i[u + n[h]];
-			if (h <= a || r < kt) continue;
+			if (h <= a || r < Zt) continue;
 			let o = Fe(t.position, e[h].position);
-			o >= kt && o <= r && m.push({
+			o >= Zt && o <= r && m.push({
 				start: a,
 				end: h,
 				length: o
@@ -812,11 +1006,11 @@ function jt(e) {
 }
 //#endregion
 //#region src/structure/images.ts
-var Mt = 1e-4;
-function Nt(e, t) {
+var en = 1e-4;
+function tn(e, t) {
 	let n = [];
 	return e.forEach((e, r) => {
-		let i = e.fractional.map((e) => z(e, Mt));
+		let i = e.fractional.map((e) => I(e, en));
 		if (n.push({
 			siteIndex: r,
 			fractional: i,
@@ -826,7 +1020,7 @@ function Nt(e, t) {
 			0,
 			1,
 			2
-		].filter((e) => i[e] < Mt), o = 1 << a.length;
+		].filter((e) => i[e] < en), o = 1 << a.length;
 		for (let e = 1; e < o; e += 1) {
 			let t = [
 				i[0],
@@ -845,19 +1039,17 @@ function Nt(e, t) {
 }
 //#endregion
 //#region src/scene/build.ts
-function Pt(e) {
+function nn(e) {
 	let t = [];
 	for (let n of e.sites) for (let e of n.species) {
-		let n = Se(e.element);
+		let n = ke(e.element);
 		t.includes(n) || t.push(n);
 	}
 	return t;
 }
-function Ft(e, t = {}) {
-	let n = Nt(e.sites, t.imageAtoms ?? !0).map((t) => {
-		let n = e.sites[t.siteIndex];
-		if (!n) throw Error(`Site ${t.siteIndex} is missing.`);
-		let r = n.species[0];
+function rn(e, t = {}) {
+	let n = tn(e.sites, t.imageAtoms ?? !0).map((t) => {
+		let n = e.sites[t.siteIndex], r = n.species[0];
 		if (!r) throw Error(`Site ${n.label} has no species.`);
 		return {
 			siteIndex: t.siteIndex,
@@ -871,20 +1063,20 @@ function Ft(e, t = {}) {
 	return {
 		cell: e.lattice.vectors,
 		atoms: n,
-		bonds: jt(n),
-		elements: Pt(e)
+		bonds: $t(n),
+		elements: nn(e)
 	};
 }
 //#endregion
 //#region node_modules/three/examples/jsm/controls/TrackballControls.js
-var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt = 1e-6, q = {
+var an = { type: "change" }, on = { type: "start" }, sn = { type: "end" }, cn = 1e-6, q = {
 	NONE: -1,
 	ROTATE: 0,
 	ZOOM: 1,
 	PAN: 2,
 	TOUCH_ROTATE: 3,
 	TOUCH_ZOOM_PAN: 4
-}, Bt = new j(), J = new j(), Vt = new M(), Ht = new M(), Ut = new M(), Y = new A(), Wt = new M(), Gt = new M(), Kt = new M(), qt = new M(), Jt = class extends l {
+}, ln = new D(), J = new D(), un = new O(), dn = new O(), fn = new O(), Y = new E(), pn = new O(), mn = new O(), hn = new O(), X = new O(), gn = class extends l {
 	constructor(e, t = null) {
 		super(e, t), this.screen = {
 			left: 0,
@@ -896,10 +1088,10 @@ var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt =
 			"KeyS",
 			"KeyD"
 		], this.mouseButtons = {
-			LEFT: S.ROTATE,
-			MIDDLE: S.DOLLY,
-			RIGHT: S.PAN
-		}, this.target = new M(), this.state = q.NONE, this.keyState = q.NONE, this._lastPosition = new M(), this._lastUp = new M(), this._lastZoom = 1, this._touchZoomDistanceStart = 0, this._touchZoomDistanceEnd = 0, this._touchRollAngle = 0, this._touchRollPointerIds = "", this._lastAngle = 0, this._lastRollAngle = 0, this._eye = new M(), this._movePrev = new j(), this._moveCurr = new j(), this._lastAxis = new M(), this._zoomStart = new j(), this._zoomEnd = new j(), this._panStart = new j(), this._panEnd = new j(), this._pointers = [], this._pointerPositions = {}, this._onPointerMove = Xt.bind(this), this._onPointerDown = Yt.bind(this), this._onPointerUp = Zt.bind(this), this._onPointerCancel = Qt.bind(this), this._onContextMenu = on.bind(this), this._onMouseWheel = an.bind(this), this._onKeyDown = en.bind(this), this._onKeyUp = $t.bind(this), this._onTouchStart = sn.bind(this), this._onTouchMove = cn.bind(this), this._onTouchEnd = ln.bind(this), this._onMouseDown = tn.bind(this), this._onMouseMove = nn.bind(this), this._onMouseUp = rn.bind(this), this._target0 = this.target.clone(), this._position0 = this.object.position.clone(), this._up0 = this.object.up.clone(), this._zoom0 = this.object.zoom, t !== null && (this.connect(t), this.handleResize()), this.update();
+			LEFT: b.ROTATE,
+			MIDDLE: b.DOLLY,
+			RIGHT: b.PAN
+		}, this.target = new O(), this.state = q.NONE, this.keyState = q.NONE, this._lastPosition = new O(), this._lastUp = new O(), this._lastZoom = 1, this._touchZoomDistanceStart = 0, this._touchZoomDistanceEnd = 0, this._touchRollAngle = 0, this._touchRollPointerIds = "", this._lastAngle = 0, this._lastRollAngle = 0, this._eye = new O(), this._movePrev = new D(), this._moveCurr = new D(), this._lastAxis = new O(), this._zoomStart = new D(), this._zoomEnd = new D(), this._panStart = new D(), this._panEnd = new D(), this._pointers = [], this._pointerPositions = {}, this._onPointerMove = vn.bind(this), this._onPointerDown = _n.bind(this), this._onPointerUp = yn.bind(this), this._onPointerCancel = bn.bind(this), this._onContextMenu = Dn.bind(this), this._onMouseWheel = En.bind(this), this._onKeyDown = Sn.bind(this), this._onKeyUp = xn.bind(this), this._onTouchStart = On.bind(this), this._onTouchMove = kn.bind(this), this._onTouchEnd = An.bind(this), this._onMouseDown = Cn.bind(this), this._onMouseMove = wn.bind(this), this._onMouseUp = Tn.bind(this), this._target0 = this.target.clone(), this._position0 = this.object.position.clone(), this._up0 = this.object.up.clone(), this._zoom0 = this.object.zoom, t !== null && (this.connect(t), this.handleResize()), this.update();
 	}
 	connect(e) {
 		super.connect(e), window.addEventListener("keydown", this._onKeyDown), window.addEventListener("keyup", this._onKeyUp), this.domElement.addEventListener("pointerdown", this._onPointerDown), this.domElement.addEventListener("pointercancel", this._onPointerCancel), this.domElement.addEventListener("wheel", this._onMouseWheel, { passive: !1 }), this.domElement.addEventListener("contextmenu", this._onContextMenu), this.domElement.style.touchAction = "none";
@@ -917,16 +1109,16 @@ var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt =
 	update() {
 		if (this._eye.subVectors(this.object.position, this.target), this.noRotate || (this._rotateCamera(), this.multiTouchRoll === !0 && this._rollCamera()), this.noZoom || this._zoomCamera(), this.noPan || this._panCamera(), this.object.position.addVectors(this.target, this._eye), this.object.isPerspectiveCamera) {
 			this._checkDistances(), this.object.lookAt(this.target);
-			let e = this._lastPosition.distanceToSquared(this.object.position) > zt, t = this._lastUp.distanceToSquared(this.object.up) > zt;
-			(e || t) && (this.dispatchEvent(It), this._lastPosition.copy(this.object.position), this._lastUp.copy(this.object.up));
+			let e = this._lastPosition.distanceToSquared(this.object.position) > cn, t = this._lastUp.distanceToSquared(this.object.up) > cn;
+			(e || t) && (this.dispatchEvent(an), this._lastPosition.copy(this.object.position), this._lastUp.copy(this.object.up));
 		} else if (this.object.isOrthographicCamera) {
 			this.object.lookAt(this.target);
-			let e = this._lastPosition.distanceToSquared(this.object.position) > zt, t = this._lastUp.distanceToSquared(this.object.up) > zt, n = this._lastZoom !== this.object.zoom;
-			(e || t || n) && (this.dispatchEvent(It), this._lastPosition.copy(this.object.position), this._lastUp.copy(this.object.up), this._lastZoom = this.object.zoom);
+			let e = this._lastPosition.distanceToSquared(this.object.position) > cn, t = this._lastUp.distanceToSquared(this.object.up) > cn, n = this._lastZoom !== this.object.zoom;
+			(e || t || n) && (this.dispatchEvent(an), this._lastPosition.copy(this.object.position), this._lastUp.copy(this.object.up), this._lastZoom = this.object.zoom);
 		} else console.warn("THREE.TrackballControls: Unsupported camera type.");
 	}
 	reset() {
-		this.state = q.NONE, this.keyState = q.NONE, this.target.copy(this._target0), this.object.position.copy(this._position0), this.object.up.copy(this._up0), this.object.zoom = this._zoom0, this.object.updateProjectionMatrix(), this._eye.subVectors(this.object.position, this.target), this.object.lookAt(this.target), this.dispatchEvent(It), this._lastPosition.copy(this.object.position), this._lastUp.copy(this.object.up), this._lastZoom = this.object.zoom;
+		this.state = q.NONE, this.keyState = q.NONE, this.target.copy(this._target0), this.object.position.copy(this._position0), this.object.up.copy(this._up0), this.object.zoom = this._zoom0, this.object.updateProjectionMatrix(), this._eye.subVectors(this.object.position, this.target), this.object.lookAt(this.target), this.dispatchEvent(an), this._lastPosition.copy(this.object.position), this._lastUp.copy(this.object.up), this._lastZoom = this.object.zoom;
 	}
 	_panCamera() {
 		if (J.copy(this._panEnd).sub(this._panStart), J.lengthSq()) {
@@ -934,20 +1126,20 @@ var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt =
 				let e = (this.object.right - this.object.left) / this.object.zoom / this.domElement.clientWidth, t = (this.object.top - this.object.bottom) / this.object.zoom / this.domElement.clientWidth;
 				J.x *= e, J.y *= t;
 			}
-			J.multiplyScalar(this._eye.length() * this.panSpeed), Ht.copy(this._eye).cross(this.object.up).setLength(J.x), Ht.add(Vt.copy(this.object.up).setLength(J.y)), this.object.position.add(Ht), this.target.add(Ht), this.staticMoving ? this._panStart.copy(this._panEnd) : this._panStart.add(J.subVectors(this._panEnd, this._panStart).multiplyScalar(this.dynamicDampingFactor));
+			J.multiplyScalar(this._eye.length() * this.panSpeed), dn.copy(this._eye).cross(this.object.up).setLength(J.x), dn.add(un.copy(this.object.up).setLength(J.y)), this.object.position.add(dn), this.target.add(dn), this.staticMoving ? this._panStart.copy(this._panEnd) : this._panStart.add(J.subVectors(this._panEnd, this._panStart).multiplyScalar(this.dynamicDampingFactor));
 		}
 	}
 	_rotateCamera() {
-		qt.set(this._moveCurr.x - this._movePrev.x, this._moveCurr.y - this._movePrev.y, 0);
-		let e = qt.length();
-		e ? (this._eye.copy(this.object.position).sub(this.target), Wt.copy(this._eye).normalize(), Gt.copy(this.object.up).normalize(), Kt.crossVectors(Gt, Wt).normalize(), Gt.setLength(this._moveCurr.y - this._movePrev.y), Kt.setLength(this._moveCurr.x - this._movePrev.x), qt.copy(Gt.add(Kt)), Ut.crossVectors(qt, this._eye).normalize(), e *= this.rotateSpeed, Y.setFromAxisAngle(Ut, e), this._eye.applyQuaternion(Y), this.object.up.applyQuaternion(Y), this._lastAxis.copy(Ut), this._lastAngle = e) : !this.staticMoving && this._lastAngle && (this._lastAngle *= Math.sqrt(1 - this.dynamicDampingFactor), this._eye.copy(this.object.position).sub(this.target), Y.setFromAxisAngle(this._lastAxis, this._lastAngle), this._eye.applyQuaternion(Y), this.object.up.applyQuaternion(Y)), this._movePrev.copy(this._moveCurr);
+		X.set(this._moveCurr.x - this._movePrev.x, this._moveCurr.y - this._movePrev.y, 0);
+		let e = X.length();
+		e ? (this._eye.copy(this.object.position).sub(this.target), pn.copy(this._eye).normalize(), mn.copy(this.object.up).normalize(), hn.crossVectors(mn, pn).normalize(), mn.setLength(this._moveCurr.y - this._movePrev.y), hn.setLength(this._moveCurr.x - this._movePrev.x), X.copy(mn.add(hn)), fn.crossVectors(X, this._eye).normalize(), e *= this.rotateSpeed, Y.setFromAxisAngle(fn, e), this._eye.applyQuaternion(Y), this.object.up.applyQuaternion(Y), this._lastAxis.copy(fn), this._lastAngle = e) : !this.staticMoving && this._lastAngle && (this._lastAngle *= Math.sqrt(1 - this.dynamicDampingFactor), this._eye.copy(this.object.position).sub(this.target), Y.setFromAxisAngle(this._lastAxis, this._lastAngle), this._eye.applyQuaternion(Y), this.object.up.applyQuaternion(Y)), this._movePrev.copy(this._moveCurr);
 	}
 	_rollCamera() {
 		let e = this._getTouchRollAngle();
 		if (e) this._lastRollAngle = e * this.rollSpeed;
 		else if (!this.staticMoving && this._lastRollAngle) this._lastRollAngle *= Math.sqrt(1 - this.dynamicDampingFactor);
 		else return;
-		Wt.copy(this._eye).normalize(), Y.setFromAxisAngle(Wt, this._lastRollAngle), this.object.up.applyQuaternion(Y);
+		pn.copy(this._eye).normalize(), Y.setFromAxisAngle(pn, this._lastRollAngle), this.object.up.applyQuaternion(Y);
 	}
 	_getTouchRollAngle() {
 		let e = this._pointers[0], t = this._pointers[1];
@@ -959,13 +1151,13 @@ var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt =
 	}
 	_zoomCamera() {
 		let e;
-		this.state === q.TOUCH_ZOOM_PAN ? (e = this._touchZoomDistanceStart / this._touchZoomDistanceEnd, this._touchZoomDistanceStart = this._touchZoomDistanceEnd, this.object.isPerspectiveCamera ? this._eye.multiplyScalar(e) : this.object.isOrthographicCamera ? (this.object.zoom = ne.clamp(this.object.zoom / e, this.minZoom, this.maxZoom), this._lastZoom !== this.object.zoom && this.object.updateProjectionMatrix()) : console.warn("THREE.TrackballControls: Unsupported camera type")) : (e = 1 + (this._zoomEnd.y - this._zoomStart.y) * this.zoomSpeed, e !== 1 && e > 0 && (this.object.isPerspectiveCamera ? this._eye.multiplyScalar(e) : this.object.isOrthographicCamera ? (this.object.zoom = ne.clamp(this.object.zoom / e, this.minZoom, this.maxZoom), this._lastZoom !== this.object.zoom && this.object.updateProjectionMatrix()) : console.warn("THREE.TrackballControls: Unsupported camera type")), this.staticMoving ? this._zoomStart.copy(this._zoomEnd) : this._zoomStart.y += (this._zoomEnd.y - this._zoomStart.y) * this.dynamicDampingFactor);
+		this.state === q.TOUCH_ZOOM_PAN ? (e = this._touchZoomDistanceStart / this._touchZoomDistanceEnd, this._touchZoomDistanceStart = this._touchZoomDistanceEnd, this.object.isPerspectiveCamera ? this._eye.multiplyScalar(e) : this.object.isOrthographicCamera ? (this.object.zoom = ie.clamp(this.object.zoom / e, this.minZoom, this.maxZoom), this._lastZoom !== this.object.zoom && this.object.updateProjectionMatrix()) : console.warn("THREE.TrackballControls: Unsupported camera type")) : (e = 1 + (this._zoomEnd.y - this._zoomStart.y) * this.zoomSpeed, e !== 1 && e > 0 && (this.object.isPerspectiveCamera ? this._eye.multiplyScalar(e) : this.object.isOrthographicCamera ? (this.object.zoom = ie.clamp(this.object.zoom / e, this.minZoom, this.maxZoom), this._lastZoom !== this.object.zoom && this.object.updateProjectionMatrix()) : console.warn("THREE.TrackballControls: Unsupported camera type")), this.staticMoving ? this._zoomStart.copy(this._zoomEnd) : this._zoomStart.y += (this._zoomEnd.y - this._zoomStart.y) * this.dynamicDampingFactor);
 	}
 	_getMouseOnScreen(e, t) {
-		return Bt.set((e - this.screen.left) / this.screen.width, (t - this.screen.top) / this.screen.height), Bt;
+		return ln.set((e - this.screen.left) / this.screen.width, (t - this.screen.top) / this.screen.height), ln;
 	}
 	_getMouseOnCircle(e, t) {
-		return Bt.set((e - this.screen.width * .5 - this.screen.left) / (this.screen.width * .5), (this.screen.height + 2 * (this.screen.top - t)) / this.screen.width), Bt;
+		return ln.set((e - this.screen.width * .5 - this.screen.left) / (this.screen.width * .5), (this.screen.height + 2 * (this.screen.top - t)) / this.screen.width), ln;
 	}
 	_addPointer(e) {
 		this._pointers.push(e);
@@ -979,7 +1171,7 @@ var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt =
 	}
 	_trackPointer(e) {
 		let t = this._pointerPositions[e.pointerId];
-		t === void 0 && (t = new j(), this._pointerPositions[e.pointerId] = t), t.set(e.pageX, e.pageY);
+		t === void 0 && (t = new D(), this._pointerPositions[e.pointerId] = t), t.set(e.pageX, e.pageY);
 	}
 	_getSecondPointerPosition(e) {
 		let t = e.pointerId === this._pointers[0].pointerId ? this._pointers[1] : this._pointers[0];
@@ -989,25 +1181,25 @@ var It = { type: "change" }, Lt = { type: "start" }, Rt = { type: "end" }, zt =
 		(!this.noZoom || !this.noPan) && (this._eye.lengthSq() > this.maxDistance * this.maxDistance && (this.object.position.addVectors(this.target, this._eye.setLength(this.maxDistance)), this._zoomStart.copy(this._zoomEnd)), this._eye.lengthSq() < this.minDistance * this.minDistance && (this.object.position.addVectors(this.target, this._eye.setLength(this.minDistance)), this._zoomStart.copy(this._zoomEnd)));
 	}
 };
-function Yt(e) {
+function _n(e) {
 	this.enabled !== !1 && (this._pointers.length === 0 && (this.domElement.setPointerCapture(e.pointerId), this.domElement.ownerDocument.addEventListener("pointermove", this._onPointerMove), this.domElement.ownerDocument.addEventListener("pointerup", this._onPointerUp)), this._addPointer(e), e.pointerType === "touch" ? this._onTouchStart(e) : this._onMouseDown(e));
 }
-function Xt(e) {
+function vn(e) {
 	this.enabled !== !1 && (e.pointerType === "touch" ? this._onTouchMove(e) : this._onMouseMove(e));
 }
-function Zt(e) {
+function yn(e) {
 	this.enabled !== !1 && (e.pointerType === "touch" ? this._onTouchEnd(e) : this._onMouseUp(), this._removePointer(e), this._pointers.length === 0 && (this.domElement.releasePointerCapture(e.pointerId), this.domElement.ownerDocument.removeEventListener("pointermove", this._onPointerMove), this.domElement.ownerDocument.removeEventListener("pointerup", this._onPointerUp)));
 }
-function Qt(e) {
+function bn(e) {
 	this._removePointer(e);
 }
-function $t() {
+function xn() {
 	this.enabled !== !1 && (this.keyState = q.NONE, window.addEventListener("keydown", this._onKeyDown));
 }
-function en(e) {
+function Sn(e) {
 	this.enabled !== !1 && (window.removeEventListener("keydown", this._onKeyDown), this.keyState === q.NONE && (e.code === this.keys[q.ROTATE] && !this.noRotate ? this.keyState = q.ROTATE : e.code === this.keys[q.ZOOM] && !this.noZoom ? this.keyState = q.ZOOM : e.code === this.keys[q.PAN] && !this.noPan && (this.keyState = q.PAN)));
 }
-function tn(e) {
+function Cn(e) {
 	let t;
 	switch (e.button) {
 		case 0:
@@ -1022,28 +1214,28 @@ function tn(e) {
 		default: t = -1;
 	}
 	switch (t) {
-		case S.DOLLY:
+		case b.DOLLY:
 			this.state = q.ZOOM;
 			break;
-		case S.ROTATE:
+		case b.ROTATE:
 			this.state = q.ROTATE;
 			break;
-		case S.PAN:
+		case b.PAN:
 			this.state = q.PAN;
 			break;
 		default: this.state = q.NONE;
 	}
 	let n = this.keyState === q.NONE ? this.state : this.keyState;
-	n === q.ROTATE && !this.noRotate ? (this._moveCurr.copy(this._getMouseOnCircle(e.pageX, e.pageY)), this._movePrev.copy(this._moveCurr)) : n === q.ZOOM && !this.noZoom ? (this._zoomStart.copy(this._getMouseOnScreen(e.pageX, e.pageY)), this._zoomEnd.copy(this._zoomStart)) : n === q.PAN && !this.noPan && (this._panStart.copy(this._getMouseOnScreen(e.pageX, e.pageY)), this._panEnd.copy(this._panStart)), this.dispatchEvent(Lt);
+	n === q.ROTATE && !this.noRotate ? (this._moveCurr.copy(this._getMouseOnCircle(e.pageX, e.pageY)), this._movePrev.copy(this._moveCurr)) : n === q.ZOOM && !this.noZoom ? (this._zoomStart.copy(this._getMouseOnScreen(e.pageX, e.pageY)), this._zoomEnd.copy(this._zoomStart)) : n === q.PAN && !this.noPan && (this._panStart.copy(this._getMouseOnScreen(e.pageX, e.pageY)), this._panEnd.copy(this._panStart)), this.dispatchEvent(on);
 }
-function nn(e) {
+function wn(e) {
 	let t = this.keyState === q.NONE ? this.state : this.keyState;
 	t === q.ROTATE && !this.noRotate ? this._moveCurr.copy(this._getMouseOnCircle(e.pageX, e.pageY)) : t === q.ZOOM && !this.noZoom ? this._zoomEnd.copy(this._getMouseOnScreen(e.pageX, e.pageY)) : t === q.PAN && !this.noPan && this._panEnd.copy(this._getMouseOnScreen(e.pageX, e.pageY));
 }
-function rn() {
-	this.state = q.NONE, this.dispatchEvent(Rt);
+function Tn() {
+	this.state = q.NONE, this.dispatchEvent(sn);
 }
-function an(e) {
+function En(e) {
 	if (this.enabled !== !1 && this.noZoom !== !0) {
 		switch (e.preventDefault(), e.deltaMode) {
 			case 2:
@@ -1054,13 +1246,13 @@ function an(e) {
 				break;
 			default: this._zoomStart.y -= e.deltaY * 25e-5;
 		}
-		this.dispatchEvent(Lt), this.dispatchEvent(Rt);
+		this.dispatchEvent(on), this.dispatchEvent(sn);
 	}
 }
-function on(e) {
+function Dn(e) {
 	this.enabled !== !1 && e.preventDefault();
 }
-function sn(e) {
+function On(e) {
 	switch (this._trackPointer(e), this._pointers.length) {
 		case 1:
 			this.state = q.TOUCH_ROTATE, this._moveCurr.copy(this._getMouseOnCircle(this._pointers[0].pageX, this._pointers[0].pageY)), this._movePrev.copy(this._moveCurr);
@@ -1072,9 +1264,9 @@ function sn(e) {
 			let n = (this._pointers[0].pageX + this._pointers[1].pageX) / 2, r = (this._pointers[0].pageY + this._pointers[1].pageY) / 2;
 			this._panStart.copy(this._getMouseOnScreen(n, r)), this._panEnd.copy(this._panStart);
 	}
-	this.dispatchEvent(Lt);
+	this.dispatchEvent(on);
 }
-function cn(e) {
+function kn(e) {
 	switch (this._trackPointer(e), this._pointers.length) {
 		case 1:
 			this._moveCurr.copy(this._getMouseOnCircle(e.pageX, e.pageY));
@@ -1086,7 +1278,7 @@ function cn(e) {
 			this._panEnd.copy(this._getMouseOnScreen(i, a));
 	}
 }
-function ln(e) {
+function An(e) {
 	switch (this._pointers.length) {
 		case 0:
 			this.state = q.NONE;
@@ -1102,43 +1294,43 @@ function ln(e) {
 				break;
 			}
 	}
-	this.dispatchEvent(Rt);
+	this.dispatchEvent(sn);
 }
 //#endregion
 //#region src/render/camera.ts
-var un = 1 / 3, dn = 1 / 6, fn = 2, pn = 1e-12, mn = new M(0, 0, -1), hn = new M(0, 1, 0);
-function gn(e, t) {
+var jn = 1 / 3, Mn = 1 / 6, Nn = 2, Pn = 1e-12, Fn = new O(0, 0, -1), In = new O(0, 1, 0);
+function Ln(e, t) {
 	let n = e.clone().sub(t.clone().multiplyScalar(e.dot(t)));
-	return n.lengthSq() < pn ? null : n.normalize();
+	return n.lengthSq() < Pn ? null : n.normalize();
 }
-function _n(e) {
+function Rn(e) {
 	for (let t of [
-		new M(0, 0, 1),
-		new M(0, 1, 0),
-		new M(1, 0, 0)
+		new O(0, 0, 1),
+		new O(0, 1, 0),
+		new O(1, 0, 0)
 	]) {
-		let n = gn(t, e);
+		let n = Ln(t, e);
 		if (n) return n;
 	}
-	return new M(0, 1, 0);
+	return new O(0, 1, 0);
 }
-function vn(e) {
-	let t = new M(...e[0]), n = new M(...e[1]), r = new M(...e[2]).normalize(), i = gn(t, r) ?? gn(n, r) ?? _n(r), a = r.clone().cross(i).normalize(), o = i.clone().add(a.multiplyScalar(un)).add(r.clone().multiplyScalar(dn)).normalize();
+function zn(e) {
+	let t = new O(...e[0]), n = new O(...e[1]), r = new O(...e[2]).normalize(), i = Ln(t, r) ?? Ln(n, r) ?? Rn(r), a = r.clone().cross(i).normalize(), o = i.clone().add(a.multiplyScalar(jn)).add(r.clone().multiplyScalar(Mn)).normalize();
 	return {
 		outward: o,
-		up: gn(r, o) ?? _n(o)
+		up: Ln(r, o) ?? Rn(o)
 	};
 }
-function yn(e) {
+function Bn(e) {
 	return Math.max(4, e * 4);
 }
-function bn(e) {
-	let { outward: t, up: n } = vn(e), r = n.clone().cross(t).normalize(), i = t.clone().cross(r).normalize(), a = new C().makeBasis(r, i, t);
-	return new A().setFromRotationMatrix(a).normalize();
+function Vn(e) {
+	let { outward: t, up: n } = zn(e), r = n.clone().cross(t).normalize(), i = t.clone().cross(r).normalize(), a = new ae().makeBasis(r, i, t);
+	return new E().setFromRotationMatrix(a).normalize();
 }
-function xn(e) {
+function Hn(e) {
 	return {
-		quaternion: Cn(bn(e)),
+		quaternion: Wn(Vn(e)),
 		target: [
 			0,
 			0,
@@ -1147,11 +1339,11 @@ function xn(e) {
 		scale: 1
 	};
 }
-function Sn(e, t, n, r) {
-	let i = new A(...t.quaternion).normalize(), a = new M(...t.target), o = mn.clone().applyQuaternion(i);
-	e.position.copy(a).sub(o.multiplyScalar(n)), e.up.copy(hn.clone().applyQuaternion(i)), e.quaternion.copy(i), e.near = .01, e.far = Math.max(1e3, n + r * 8), e.updateProjectionMatrix();
+function Un(e, t, n, r) {
+	let i = new E(...t.quaternion).normalize(), a = new O(...t.target), o = Fn.clone().applyQuaternion(i);
+	e.position.copy(a).sub(o.multiplyScalar(n)), e.up.copy(In.clone().applyQuaternion(i)), e.quaternion.copy(i), e.near = .01, e.far = Math.max(1e3, n + r * 8), e.updateProjectionMatrix();
 }
-function Cn(e) {
+function Wn(e) {
 	return [
 		e.x,
 		e.y,
@@ -1159,10 +1351,10 @@ function Cn(e) {
 		e.w
 	];
 }
-function wn(e, t) {
-	let n = new M(1, 0, 0).applyQuaternion(t), r = new M(0, 1, 0).applyQuaternion(t), i = Infinity, a = -Infinity, o = Infinity, s = -Infinity;
+function Gn(e, t) {
+	let n = new O(1, 0, 0).applyQuaternion(t), r = new O(0, 1, 0).applyQuaternion(t), i = Infinity, a = -Infinity, o = Infinity, s = -Infinity;
 	for (let t of [e.min.x, e.max.x]) for (let c of [e.min.y, e.max.y]) for (let l of [e.min.z, e.max.z]) {
-		let e = new M(t, c, l), u = e.dot(n), d = e.dot(r);
+		let e = new O(t, c, l), u = e.dot(n), d = e.dot(r);
 		i = Math.min(i, u), a = Math.max(a, u), o = Math.min(o, d), s = Math.max(s, d);
 	}
 	return {
@@ -1170,31 +1362,31 @@ function wn(e, t) {
 		height: Math.max(1, s - o)
 	};
 }
-function Tn(e, t, n, r) {
-	let i = wn(e, t), a = Math.sqrt(Math.max(1, n) * Math.max(1, r)), o = Math.sqrt(i.width * i.height);
-	return Math.max(.01, a / (o * fn));
+function Kn(e, t, n, r) {
+	let i = Gn(e, t), a = Math.sqrt(Math.max(1, n) * Math.max(1, r)), o = Math.sqrt(i.width * i.height);
+	return Math.max(.01, a / (o * Nn));
 }
-function En(e, t, n) {
+function qn(e, t, n) {
 	e.left = -t / 2, e.right = t / 2, e.top = n / 2, e.bottom = -n / 2, e.updateProjectionMatrix();
 }
 //#endregion
 //#region src/render/materials.ts
-var Dn = .1, On = .6, kn = .8, An = 2.2, jn = [
+var Jn = .1, Yn = .6, Xn = .8, Zn = 2.2, Qn = [
 	.3,
 	.2,
 	0
-], Mn = "#fafafa", Nn = "#444444", Pn = "#f2f2f2", Fn = .3, In = "6.28318530718";
-function Ln(e, t) {
+], $n = "#fafafa", er = "#444444", tr = "#f2f2f2", nr = .3, rr = "6.28318530718";
+function ir(e, t) {
 	return t.reduce((e, [t, n]) => {
 		if (!e.includes(t)) throw Error(`bravais cannot draw with this three.js: its shader has no ${t}.`);
 		return e.replace(t, n);
 	}, e);
 }
-function Rn(e) {
-	return Ln(e, [["#include <common>", "#include <common>\nflat varying int vSectorSite;\nflat varying vec3 vSphereCenter;\nflat varying float vSphereRadius;\nflat varying vec2 vDepthCoefficients;\nvarying vec3 vSpherePoint;"], ["#include <project_vertex>", "mat4 sphereMatrix = modelViewMatrix * instanceMatrix;\nvSphereCenter = sphereMatrix[3].xyz;\nvSphereRadius = length(sphereMatrix[0].xyz);\nvSpherePoint = vSphereCenter + vec3(position.xy * vSphereRadius, 0.0);\nvDepthCoefficients = vec2(projectionMatrix[2][2], projectionMatrix[3][2]);\nvSectorSite = gl_InstanceID;\nvec4 mvPosition = vec4(vSpherePoint, 1.0);\ngl_Position = projectionMatrix * mvPosition;"]]);
+function ar(e) {
+	return ir(e, [["#include <common>", "#include <common>\nflat varying int vSectorSite;\nflat varying vec3 vSphereCenter;\nflat varying float vSphereRadius;\nflat varying vec2 vDepthCoefficients;\nvarying vec3 vSpherePoint;"], ["#include <project_vertex>", "mat4 sphereMatrix = modelViewMatrix * instanceMatrix;\nvSphereCenter = sphereMatrix[3].xyz;\nvSphereRadius = length(sphereMatrix[0].xyz);\nvSpherePoint = vSphereCenter + vec3(position.xy * vSphereRadius, 0.0);\nvDepthCoefficients = vec2(projectionMatrix[2][2], projectionMatrix[3][2]);\nvSectorSite = gl_InstanceID;\nvec4 mvPosition = vec4(vSpherePoint, 1.0);\ngl_Position = projectionMatrix * mvPosition;"]]);
 }
-function zn(e) {
-	return Ln(e, [
+function or(e) {
+	return ir(e, [
 		["#include <common>", "#include <common>\nuniform sampler2D sectorTexture;\nuniform float vacancyOpacity;\nflat varying int vSectorSite;\nflat varying vec3 vSphereCenter;\nflat varying float vSphereRadius;\nflat varying vec2 vDepthCoefficients;\nvarying vec3 vSpherePoint;"],
 		["#include <clipping_planes_fragment>", "// Where the view ray meets the sphere. The outline is smoothed over one\n// pixel through the alpha: sample coverage, or blending in a see-through layer.\nvec2 sphereOffset = vSpherePoint.xy - vSphereCenter.xy;\nfloat sphereDistance = length(sphereOffset);\nfloat sphereCoverage = clamp(\n  (vSphereRadius - sphereDistance) / max(fwidth(sphereDistance), 1e-6) + 0.5,\n  0.0,\n  1.0\n);\nif (sphereCoverage <= 0.0) {\n  discard;\n}\nfloat sphereHeight = sqrt(\n  max(0.0, vSphereRadius * vSphereRadius - dot(sphereOffset, sphereOffset))\n);\nvec3 sphereNormal = vec3(sphereOffset, sphereHeight) / vSphereRadius;\nfloat sphereZ = vSphereCenter.z + sphereHeight;\ngl_FragDepth = (vDepthCoefficients.x * sphereZ + vDepthCoefficients.y) * 0.5 + 0.5;\n#include <clipping_planes_fragment>"],
 		["#include <color_fragment>", `#include <color_fragment>
@@ -1202,7 +1394,7 @@ function zn(e) {
   // A pie chart facing the viewer, like VESTA's occupancy pies: the instance
   // colour fills the first sector from 12 o'clock clockwise, then each
   // texel's colour from its stop on.
-  float sectorAngle = fract(atan(sphereOffset.x, sphereOffset.y) / ${In});
+  float sectorAngle = fract(atan(sphereOffset.x, sphereOffset.y) / ${rr});
   vec3 sectorColor = vColor.rgb;
   float sectorOpacity = 1.0;
   int sectorRow = vSectorSite / 256;
@@ -1222,53 +1414,53 @@ function zn(e) {
 		["#include <normal_fragment_begin>", "#include <normal_fragment_begin>\nnormal = sphereNormal;\nnonPerturbedNormal = normal;"]
 	]);
 }
-function Bn(e, t, n) {
-	let r = e < 1 || n, i = new T({
+function sr(e, t, n) {
+	let r = e < 1 || n, i = new S({
 		color: "#ffffff",
-		metalness: Dn,
-		roughness: On,
+		metalness: Jn,
+		roughness: Yn,
 		opacity: e,
 		transparent: r,
 		alphaToCoverage: !r
 	});
 	return i.onBeforeCompile = (e) => {
-		e.uniforms.sectorTexture = { value: t }, e.uniforms.vacancyOpacity = { value: Fn }, e.vertexShader = Rn(e.vertexShader), e.fragmentShader = zn(e.fragmentShader);
+		e.uniforms.sectorTexture = { value: t }, e.uniforms.vacancyOpacity = { value: nr }, e.vertexShader = ar(e.vertexShader), e.fragmentShader = or(e.fragmentShader);
 	}, i.customProgramCacheKey = () => "bravais-atom-spheres", i;
 }
-function Vn(e) {
-	return Ln(e, [["#include <common>", "#include <common>\nuniform float capRadius;\nflat varying vec3 vTubeCenter;\nflat varying vec3 vTubeAxis;\nflat varying vec3 vAtomCenter;\nflat varying float vTubeRadius;\nflat varying float vTubeHalfLength;\nflat varying vec2 vDepthCoefficients;\nvarying vec3 vBoxPoint;"], ["#include <project_vertex>", "mat4 tubeMatrix = modelViewMatrix * instanceMatrix;\nfloat tubeLength = max(length(tubeMatrix[1].xyz), 1e-6);\nvTubeRadius = length(tubeMatrix[0].xyz);\nvTubeHalfLength = tubeLength * 0.5;\nvTubeCenter = tubeMatrix[3].xyz;\nvTubeAxis = tubeMatrix[1].xyz / tubeLength;\nfloat rim = sqrt(max(0.0, capRadius * capRadius - vTubeRadius * vTubeRadius));\nvAtomCenter = vTubeCenter - vTubeAxis * (rim + vTubeHalfLength);\nvDepthCoefficients = vec2(projectionMatrix[2][2], projectionMatrix[3][2]);\nvec4 mvPosition = tubeMatrix * vec4(position, 1.0);\nvBoxPoint = mvPosition.xyz;\ngl_Position = projectionMatrix * mvPosition;"]]);
+function cr(e) {
+	return ir(e, [["#include <common>", "#include <common>\nuniform float capRadius;\nflat varying vec3 vTubeCenter;\nflat varying vec3 vTubeAxis;\nflat varying vec3 vAtomCenter;\nflat varying float vTubeRadius;\nflat varying float vTubeHalfLength;\nflat varying vec2 vDepthCoefficients;\nvarying vec3 vBoxPoint;"], ["#include <project_vertex>", "mat4 tubeMatrix = modelViewMatrix * instanceMatrix;\nfloat tubeLength = max(length(tubeMatrix[1].xyz), 1e-6);\nvTubeRadius = length(tubeMatrix[0].xyz);\nvTubeHalfLength = tubeLength * 0.5;\nvTubeCenter = tubeMatrix[3].xyz;\nvTubeAxis = tubeMatrix[1].xyz / tubeLength;\nfloat rim = sqrt(max(0.0, capRadius * capRadius - vTubeRadius * vTubeRadius));\nvAtomCenter = vTubeCenter - vTubeAxis * (rim + vTubeHalfLength);\nvDepthCoefficients = vec2(projectionMatrix[2][2], projectionMatrix[3][2]);\nvec4 mvPosition = tubeMatrix * vec4(position, 1.0);\nvBoxPoint = mvPosition.xyz;\ngl_Position = projectionMatrix * mvPosition;"]]);
 }
-function Hn(e) {
-	return Ln(e, [
+function lr(e) {
+	return ir(e, [
 		["#include <common>", "#include <common>\nuniform float capRadius;\nflat varying vec3 vTubeCenter;\nflat varying vec3 vTubeAxis;\nflat varying vec3 vAtomCenter;\nflat varying float vTubeRadius;\nflat varying float vTubeHalfLength;\nflat varying vec2 vDepthCoefficients;\nvarying vec3 vBoxPoint;"],
 		["#include <clipping_planes_fragment>", "// The view ray through this pixel runs down view z. The tube's surface is\n// the nearest of: the wall outside the atom's sphere, the sphere's far side\n// inside the tube (the cut face) and the midpoint disc. Along the ray,\n// q(z) = p(z) - centre has q.a = k + (z - cz) a.z and |q|^2 = u + (z - cz)^2.\nvec2 tubePixel = vBoxPoint.xy;\nvec2 tubeOffset = tubePixel - vTubeCenter.xy;\nfloat tubeK = dot(tubeOffset, vTubeAxis.xy);\nfloat tubeU = dot(tubeOffset, tubeOffset);\nfloat axisZ = vTubeAxis.z;\nfloat quadA = 1.0 - axisZ * axisZ;\nfloat quadB = -2.0 * tubeK * axisZ;\nfloat quadC = tubeU - tubeK * tubeK - vTubeRadius * vTubeRadius;\nfloat tubeRadius2 = vTubeRadius * vTubeRadius;\n// The ray's closest approach to the axis, for the outline's coverage.\nfloat axisDistance2 = tubeU - tubeK * tubeK;\nif (quadA > 1e-6) {\n  axisDistance2 -= quadB * quadB / (4.0 * quadA);\n}\nfloat axisDistance = sqrt(max(0.0, axisDistance2));\nfloat tubeCoverage = clamp(\n  (vTubeRadius - axisDistance) / max(fwidth(axisDistance), 1e-6) + 0.5,\n  0.0,\n  1.0\n);\nif (tubeCoverage <= 0.0) {\n  discard;\n}\nfloat tubeHitZ = -1e30;\nvec3 tubeNormal = vec3(0.0, 0.0, 1.0);\nif (quadA > 1e-6) {\n  float discriminant = quadB * quadB - 4.0 * quadA * quadC;\n  if (discriminant >= 0.0) {\n    float z = vTubeCenter.z + (-quadB + sqrt(discriminant)) / (2.0 * quadA);\n    vec3 d = vec3(tubePixel, z) - vTubeCenter;\n    float s = dot(d, vTubeAxis);\n    if (abs(s) <= vTubeHalfLength && distance(vec3(tubePixel, z), vAtomCenter) >= capRadius) {\n      tubeHitZ = z;\n      tubeNormal = (d - s * vTubeAxis) / vTubeRadius;\n    }\n  }\n}\nif (axisZ > 1e-6) {\n  float z = vTubeCenter.z + (vTubeHalfLength - tubeK) / axisZ;\n  vec3 d = vec3(tubePixel, z) - vTubeCenter;\n  if (dot(d, d) - vTubeHalfLength * vTubeHalfLength <= tubeRadius2 && z > tubeHitZ &&\n      distance(vec3(tubePixel, z), vAtomCenter) >= capRadius) {\n    tubeHitZ = z;\n    tubeNormal = vTubeAxis;\n  }\n}\n{\n  vec2 m = tubePixel - vAtomCenter.xy;\n  float inside = capRadius * capRadius - dot(m, m);\n  if (inside >= 0.0) {\n    float z = vAtomCenter.z - sqrt(inside);\n    vec3 d = vec3(tubePixel, z) - vTubeCenter;\n    float s = dot(d, vTubeAxis);\n    if (abs(s) <= vTubeHalfLength && dot(d, d) - s * s <= tubeRadius2 && z > tubeHitZ) {\n      tubeHitZ = z;\n      tubeNormal = (vAtomCenter - vec3(tubePixel, z)) / capRadius;\n    }\n  }\n}\nif (tubeHitZ < -1e29) {\n  discard;\n}\ngl_FragDepth = (vDepthCoefficients.x * tubeHitZ + vDepthCoefficients.y) * 0.5 + 0.5;\n#include <clipping_planes_fragment>"],
 		["#include <color_fragment>", "#include <color_fragment>\ndiffuseColor.a *= tubeCoverage;"],
 		["#include <normal_fragment_begin>", "#include <normal_fragment_begin>\nnormal = tubeNormal;\nnonPerturbedNormal = normal;"]
 	]);
 }
-function Un(e, t) {
-	let n = e < 1, r = new T({
+function ur(e, t) {
+	let n = e < 1, r = new S({
 		color: "#ffffff",
-		metalness: Dn,
-		roughness: On,
+		metalness: Jn,
+		roughness: Yn,
 		opacity: e,
 		transparent: n,
 		alphaToCoverage: !n
 	});
 	return r.onBeforeCompile = (e) => {
-		e.uniforms.capRadius = { value: t }, e.vertexShader = Vn(e.vertexShader), e.fragmentShader = Hn(e.fragmentShader);
+		e.uniforms.capRadius = { value: t }, e.vertexShader = cr(e.vertexShader), e.fragmentShader = lr(e.fragmentShader);
 	}, r.customProgramCacheKey = () => "bravais-bond-tubes", r;
 }
-function Wn(e) {
+function dr(e) {
 	return new y({
-		color: Nn,
+		color: er,
 		opacity: e,
 		transparent: !0,
 		fog: !1
 	});
 }
-function Gn(e, n) {
-	return new T({
+function fr(e, n) {
+	return new S({
 		color: e,
 		metalness: 0,
 		roughness: .8,
@@ -1276,35 +1468,32 @@ function Gn(e, n) {
 		stencilWrite: !0,
 		stencilRef: n,
 		stencilFunc: t,
-		stencilZPass: ae
+		stencilZPass: le
 	});
 }
 //#endregion
 //#region src/render/gizmo.ts
-var Kn = {
+var pr = {
 	a: "#d27686",
 	b: "#80c393",
 	c: "#75a4dd"
-}, qn = .82, Jn = .055, Yn = .24, Xn = .13, Zn = .13, Qn = 1.3, $n = .5, er = 128, tr = "#2a2a2a", nr = "#ffffff", rr = 3.2, ir = new M(0, 1, 0);
-function ar(e, t) {
+}, mr = .82, hr = .055, gr = .24, _r = .13, vr = .13, yr = 1.3, br = .5, xr = 128, Sr = "#2a2a2a", Cr = "#ffffff", wr = 3.2, Tr = new O(0, 1, 0);
+function Er(e, t) {
 	let n = document.createElement("canvas");
-	n.width = er, n.height = er;
+	n.width = xr, n.height = xr;
 	let r = n.getContext("2d");
-	if (r) {
-		let i = er * .68;
-		r.clearRect(0, 0, n.width, n.height), r.font = `italic 600 ${i}px ${t}`, r.textAlign = "center", r.textBaseline = "middle", r.fillStyle = "#ffffff", r.fillText(e, n.width / 2, n.height / 2);
-	}
+	r && (r.font = `italic 600 ${xr * .68}px ${t}`, r.textAlign = "center", r.textBaseline = "middle", r.fillStyle = "#ffffff", r.fillText(e, n.width / 2, n.height / 2));
 	let i = new o(n);
-	return i.colorSpace = oe, i.premultiplyAlpha = !0, i.magFilter = x, i.minFilter = te, i;
+	return i.colorSpace = ue, i.premultiplyAlpha = !0, i.magFilter = ne, i.minFilter = re, i;
 }
-function or(e, t, n) {
-	let r = new _(), i = Gn(e, 1), a = new w(new u(Jn, Jn, qn, 24), i);
-	a.position.y = qn / 2;
-	let o = new w(new c(Xn, Yn, 32), i);
+function Dr(e, t, n) {
+	let r = new _(), i = fr(e, 1), a = new x(new u(hr, hr, mr, 24), i);
+	a.position.y = mr / 2;
+	let o = new x(new c(_r, gr, 32), i);
 	o.position.y = .94, r.add(a, o);
-	let s = ar(t, n), l = [[tr, D], [nr, m]];
+	let s = Er(t, n), l = [[Sr, oe], [Cr, m]];
 	for (let [e, t] of l) {
-		let n = new le(new ue({
+		let n = new pe(new me({
 			map: s,
 			color: e,
 			depthTest: !1,
@@ -1314,49 +1503,46 @@ function or(e, t, n) {
 			stencilRef: 1,
 			stencilFunc: t
 		}));
-		n.scale.set($n, $n, 1), n.position.y = Qn, n.renderOrder = 10, r.add(n);
+		n.scale.set(br, br, 1), n.position.y = yr, n.renderOrder = 10, r.add(n);
 	}
 	return r;
 }
-var sr = class {
-	scene = new se();
-	camera = new k(-1, 1, 1, -1, .1, 20);
+var Or = class {
+	scene = new de();
+	camera = new T(-3.2 / 2, wr / 2, wr / 2, -3.2 / 2, .1, 20);
 	axes = new _();
 	arrows;
 	headlight = new f("#ffffff", 1.78);
-	inverse = new A();
-	direction = new M();
+	direction = new O();
 	constructor(e) {
 		this.camera.position.set(0, 0, 5), this.camera.lookAt(0, 0, 0), this.scene.add(new n("#ffffff", .68)), this.headlight.position.set(1.6, 1.1, 5), this.scene.add(this.headlight), this.arrows = [
 			"a",
 			"b",
 			"c"
-		].map((t) => or(Kn[t], t, e));
-		let t = new w(new ce(Zn, 32, 16), Gn("#f3f2ee", 0));
+		].map((t) => Dr(pr[t], t, e));
+		let t = new x(new fe(vr, 32, 16), fr("#f3f2ee", 0));
 		this.axes.add(...this.arrows, t), this.scene.add(this.axes);
 	}
 	setCell(e) {
 		this.arrows.forEach((t, n) => {
-			t.quaternion.setFromUnitVectors(ir, this.direction.set(...e[n]).normalize());
+			t.quaternion.setFromUnitVectors(Tr, this.direction.set(...e[n]).normalize());
 		});
 	}
 	render(e, t, n) {
-		this.axes.quaternion.copy(this.inverse.copy(t).invert());
-		let r = rr / 2;
-		this.camera.left = -1.6, this.camera.right = r, this.camera.top = r, this.camera.bottom = -1.6, this.camera.updateProjectionMatrix();
-		let i = e.autoClear;
-		e.autoClear = !1, e.setViewport(0, 0, n, n), e.setScissor(0, 0, n, n), e.setScissorTest(!0), e.clear(!1, !0, !0), e.render(this.scene, this.camera), e.setScissorTest(!1), e.autoClear = i;
+		this.axes.quaternion.copy(t).invert();
+		let r = e.autoClear;
+		e.autoClear = !1, e.setViewport(0, 0, n, n), e.setScissor(0, 0, n, n), e.setScissorTest(!0), e.clear(!1, !0, !0), e.render(this.scene, this.camera), e.setScissorTest(!1), e.autoClear = r;
 	}
 	dispose() {
 		this.axes.traverse((e) => {
-			if (e instanceof w || e instanceof le) {
+			if (e instanceof x || e instanceof pe) {
 				e.geometry.dispose();
 				let t = e.material;
 				"map" in t && t.map && t.map.dispose(), t.dispose();
 			}
 		}), this.axes.clear();
 	}
-}, cr = {
+}, kr = {
 	source: "VESTA's element colours, softened.",
 	elements: {
 		H: "#f2c0c0",
@@ -1460,21 +1646,21 @@ var sr = class {
 };
 //#endregion
 //#region src/render/oklab.ts
-function lr(e) {
+function Ar(e) {
 	return e <= .04045 ? e / 12.92 : ((e + .055) / 1.055) ** 2.4;
 }
-function ur(e) {
+function jr(e) {
 	return e <= .0031308 ? e * 12.92 : 1.055 * e ** (1 / 2.4) - .055;
 }
-function dr(e) {
-	let t = Number.parseInt(e.slice(1), 16), n = lr((t >> 16 & 255) / 255), r = lr((t >> 8 & 255) / 255), i = lr((t & 255) / 255), a = Math.cbrt(.4122214708 * n + .5363325363 * r + .0514459929 * i), o = Math.cbrt(.2119034982 * n + .6806995451 * r + .1073969566 * i), s = Math.cbrt(.0883024619 * n + .2817188376 * r + .6299787005 * i);
+function Mr(e) {
+	let t = Number.parseInt(e.slice(1), 16), n = Ar((t >> 16 & 255) / 255), r = Ar((t >> 8 & 255) / 255), i = Ar((t & 255) / 255), a = Math.cbrt(.4122214708 * n + .5363325363 * r + .0514459929 * i), o = Math.cbrt(.2119034982 * n + .6806995451 * r + .1073969566 * i), s = Math.cbrt(.0883024619 * n + .2817188376 * r + .6299787005 * i);
 	return {
 		L: .2104542553 * a + .793617785 * o - .0040720468 * s,
 		a: 1.9779984951 * a - 2.428592205 * o + .4505937099 * s,
 		b: .0259040371 * a + .7827717662 * o - .808675766 * s
 	};
 }
-function fr(e) {
+function Nr(e) {
 	let t = (e.L + .3963377774 * e.a + .2158037573 * e.b) ** 3, n = (e.L - .1055613458 * e.a - .0638541728 * e.b) ** 3, r = (e.L - .0894841775 * e.a - 1.291485548 * e.b) ** 3;
 	return [
 		4.0767416621 * t - 3.3077115913 * n + .2309699292 * r,
@@ -1482,16 +1668,16 @@ function fr(e) {
 		-.0041960863 * t - .7034186147 * n + 1.707614701 * r
 	];
 }
-function pr(e) {
-	return fr(e).every((e) => e >= -1e-4 && e <= 1.0001);
+function Pr(e) {
+	return Nr(e).every((e) => e >= -1e-4 && e <= 1.0001);
 }
-function mr(e) {
-	return `#${fr(e).map((e) => {
-		let t = ur(Math.min(1, Math.max(0, e)));
+function Fr(e) {
+	return `#${Nr(e).map((e) => {
+		let t = jr(Math.min(1, Math.max(0, e)));
 		return Math.round(t * 255).toString(16).padStart(2, "0");
 	}).join("")}`;
 }
-function hr(e) {
+function Ir(e) {
 	let t = Math.hypot(e.a, e.b), n = (Math.atan2(e.b, e.a) * 180 / Math.PI + 360) % 360;
 	return {
 		L: e.L,
@@ -1499,7 +1685,7 @@ function hr(e) {
 		h: n
 	};
 }
-function gr(e) {
+function Lr(e) {
 	let t = e.h * Math.PI / 180;
 	return {
 		L: e.L,
@@ -1507,12 +1693,12 @@ function gr(e) {
 		b: e.C * Math.sin(t)
 	};
 }
-function _r(e) {
-	if (pr(gr(e))) return e;
+function Rr(e) {
+	if (Pr(Lr(e))) return e;
 	let t = 0, n = e.C;
 	for (let r = 0; r < 24; r += 1) {
 		let r = (t + n) / 2;
-		pr(gr({
+		Pr(Lr({
 			...e,
 			C: r
 		})) ? t = r : n = r;
@@ -1524,15 +1710,15 @@ function _r(e) {
 }
 //#endregion
 //#region src/render/palette.ts
-var vr = cr.elements, yr = {
+var zr = kr.elements, Br = {
 	Cr: "#6d87c9",
 	V: "#bf4b62",
 	F: "#9bd7d0"
-}, br = /* @__PURE__ */ "O.Li.Na.K.Mg.Ca.Sr.Ba.Al.Si.Ti.Mn.Fe.Co.Ni.Cu.Zn.V.Cr.Ga.Ge.Y.Zr.Nb.Mo.Ru.Ag.Cd.In.Sn.Sb.La.Ce.Nd.Sm.Gd.Ta.W.Pt.Au.Pb.Bi.H.C.N.F.P.S.Cl.Se.Te.I.Br.B.Sc.Rb.Cs.Hf.Re.Ir.Pd.Rh.Os.Pr.Eu.Tb.Dy.Ho.Er.Tm.Yb.Lu.Th.U".split("."), xr = new Map(br.map((e, t) => [e, t])), Sr = .1, Cr = .7, X = {
+}, Vr = /* @__PURE__ */ "O.Li.Na.K.Mg.Ca.Sr.Ba.Al.Si.Ti.Mn.Fe.Co.Ni.Cu.Zn.V.Cr.Ga.Ge.Y.Zr.Nb.Mo.Ru.Ag.Cd.In.Sn.Sb.La.Ce.Nd.Sm.Gd.Ta.W.Pt.Au.Pb.Bi.H.C.N.F.P.S.Cl.Se.Te.I.Br.B.Sc.Rb.Cs.Hf.Re.Ir.Pd.Rh.Os.Pr.Eu.Tb.Dy.Ho.Er.Tm.Yb.Lu.Th.U".split("."), Hr = new Map(Vr.map((e, t) => [e, t])), Ur = .1, Wr = .7, Z = {
 	minL: .45,
 	maxL: .88,
 	maxC: .2
-}, wr = .025, Tr = .09, Er = .1, Dr = [
+}, Gr = .025, Kr = .09, qr = .1, Jr = [
 	0,
 	10,
 	-10,
@@ -1553,7 +1739,7 @@ var vr = cr.elements, yr = {
 	150,
 	-150,
 	180
-], Or = [
+], Yr = [
 	0,
 	-.05,
 	.05,
@@ -1563,12 +1749,12 @@ var vr = cr.elements, yr = {
 	.15,
 	-.2,
 	.2
-], kr = [
+], Xr = [
 	0,
 	.15,
 	-.15,
 	.3
-], Ar = [
+], Zr = [
 	0,
 	30,
 	60,
@@ -1581,78 +1767,76 @@ var vr = cr.elements, yr = {
 	270,
 	300,
 	330
-], jr = 30, Mr = .08, Nr = .15, Pr = 1.5, Fr = 2;
-function Ir(e, t) {
-	let n = (e.L - t.L) * Cr;
+], Qr = 30, $r = .08, ei = .15, ti = 1.5, ni = 2;
+function ri(e, t) {
+	let n = (e.L - t.L) * Wr;
 	return Math.hypot(n, e.a - t.a, e.b - t.b);
 }
-function Lr(e) {
+function ii(e) {
 	let t = 2166136261;
 	for (let n = 0; n < e.length; n += 1) t = Math.imul(t ^ e.charCodeAt(n), 16777619) >>> 0;
 	return t;
 }
-function Rr(e) {
-	return yr[e] ?? vr[e] ?? null;
+function ai(e) {
+	return Br[e] ?? zr[e] ?? null;
 }
-function zr(e) {
-	let t = Rr(e);
-	if (t) return hr(dr(t));
-	let n = _e.indexOf(e) + 1;
+function oi(e) {
+	let t = ai(e);
+	if (t) return Ir(Mr(t));
+	let n = Ce.indexOf(e) + 1;
 	return {
 		L: .68,
 		C: .12,
-		h: (n > 0 ? n : Lr(e)) * 137.508 % 360
+		h: (n > 0 ? n : ii(e)) * 137.508 % 360
 	};
 }
-function Br(e) {
-	let t = xr.get(e);
+function si(e) {
+	let t = Hr.get(e);
 	if (t !== void 0) return t;
-	let n = _e.indexOf(e);
-	return br.length + (n >= 0 ? n : _e.length);
+	let n = Ce.indexOf(e);
+	return Vr.length + (n >= 0 ? n : Ce.length);
 }
-function Vr(e) {
-	return _r({
-		L: Math.min(X.maxL, Math.max(X.minL, e.L)),
-		C: Math.min(X.maxC, Math.max(0, e.C)),
+function ci(e) {
+	return Rr({
+		L: Math.min(Z.maxL, Math.max(Z.minL, e.L)),
+		C: Math.min(Z.maxC, Math.max(0, e.C)),
 		h: (e.h % 360 + 360) % 360
 	});
 }
-function Hr(e, t) {
-	return _r({
+function li(e, t) {
+	return Rr({
 		L: e,
 		C: .5,
 		h: t
 	}).C;
 }
-function Ur(e, t) {
-	let n = Vr(e);
+function ui(e, t) {
 	return {
-		lch: n,
-		lab: gr(n),
+		lab: Lr(ci(e)),
 		cost: t
 	};
 }
-function Wr(e) {
+function di(e) {
 	let t = [];
-	if (e.C < wr) {
-		for (let n of Or) {
-			let r = Math.abs(n) / Mr * (n > 0 ? Pr : 1);
-			t.push(Ur({
+	if (e.C < Gr) {
+		for (let n of Yr) {
+			let r = Math.abs(n) / $r * (n > 0 ? ti : 1);
+			t.push(ui({
 				...e,
 				L: e.L + n
 			}, r));
-			for (let i of Ar) t.push(Ur({
-				L: e.L - Er + n,
-				C: Tr,
+			for (let i of Zr) t.push(ui({
+				L: e.L - qr + n,
+				C: Kr,
 				h: i
-			}, Fr + r + i / 3600));
+			}, ni + r + i / 3600));
 		}
 		return t.sort((e, t) => e.cost - t.cost);
 	}
-	let n = e.C / Math.max(1e-6, Hr(e.L, e.h));
-	for (let r of Dr) for (let i of Or) for (let a of kr) {
-		let o = Math.min(X.maxL, Math.max(X.minL, e.L + i)), s = e.h + r, c = Math.min(1, Math.max(.1, n + a)) * Hr(o, s), l = Math.abs(r) / jr + Math.abs(i) / Mr + Math.abs(a) / Nr;
-		t.push(Ur({
+	let n = e.C / Math.max(1e-6, li(e.L, e.h));
+	for (let r of Jr) for (let i of Yr) for (let a of Xr) {
+		let o = Math.min(Z.maxL, Math.max(Z.minL, e.L + i)), s = e.h + r, c = Math.min(1, Math.max(.1, n + a)) * li(o, s), l = Math.abs(r) / Qr + Math.abs(i) / $r + Math.abs(a) / ei;
+		t.push(ui({
 			L: o,
 			C: c,
 			h: s
@@ -1660,56 +1844,55 @@ function Wr(e) {
 	}
 	return t.sort((e, t) => e.cost - t.cost);
 }
-var Z = /* @__PURE__ */ new Map();
-function Gr(e, t) {
-	let n = [...Z.values()].map((e) => e.lab), r = (e) => n.reduce((t, n) => Math.min(t, Ir(e, n)), Infinity), i = gr(t);
-	if (r(i) >= Sr) return {
-		hex: e ?? mr(i),
+var Q = /* @__PURE__ */ new Map();
+function fi(e, t) {
+	let n = [...Q.values()].map((e) => e.lab), r = (e) => n.reduce((t, n) => Math.min(t, ri(e, n)), Infinity), i = Lr(t);
+	if (r(i) >= Ur) return {
+		hex: e ?? Fr(i),
 		lab: i
 	};
 	let a = null, o = -Infinity, s = Infinity, c = null, l = -Infinity;
-	for (let e of Wr(t)) {
+	for (let e of di(t)) {
 		let t = r(e.lab);
-		if (t >= Sr) {
+		if (t >= Ur) {
 			if ((e.cost < s - 1e-9 || Math.abs(e.cost - s) <= 1e-9 && t > o) && (a = e, s = e.cost, o = t), e.cost > s + 1e-9) break;
 		} else t > l && (c = e, l = t);
 	}
 	let u = a ?? c ?? {
 		lab: i,
-		lch: t,
 		cost: 0
 	};
 	return {
-		hex: mr(u.lab),
+		hex: Fr(u.lab),
 		lab: u.lab
 	};
 }
-function Kr(e) {
-	let t = [...new Set(e)].filter((e) => !Z.has(e)).sort((e, t) => Br(e) - Br(t));
-	for (let e of t) Z.set(e, Gr(Rr(e), zr(e)));
+function pi(e) {
+	let t = [...new Set(e)].filter((e) => !Q.has(e)).sort((e, t) => si(e) - si(t));
+	for (let e of t) Q.set(e, fi(ai(e), oi(e)));
 }
-function qr(e) {
-	let t = Z.get(e);
-	return t ? t.hex : (Kr([e]), Z.get(e).hex);
+function mi(e) {
+	let t = Q.get(e);
+	return t ? t.hex : (pi([e]), Q.get(e).hex);
 }
-function Jr() {
-	return [...Z].map(([e, t]) => [e, t.hex]);
+function hi() {
+	return [...Q].map(([e, t]) => [e, t.hex]);
 }
-function Yr() {
-	Z.clear();
+function gi() {
+	Q.clear();
 }
 //#endregion
 //#region src/render/legend.ts
-var Xr = "bravais-styles", Zr = "\n.bravais-viewer {\n  position: relative;\n  overflow: hidden;\n}\n.bravais-canvas {\n  position: absolute;\n  inset: 0;\n  width: 100%;\n  height: 100%;\n  display: block;\n  touch-action: none;\n}\n.bravais-legend {\n  position: absolute;\n  left: 50%;\n  bottom: 20px;\n  transform: translateX(-50%);\n  display: flex;\n  flex-wrap: wrap;\n  justify-content: center;\n  gap: 8px 16px;\n  max-width: calc(100% - 32px);\n  padding: 8px 16px;\n  border: 1px solid rgba(40, 40, 40, 0.1);\n  border-radius: 999px;\n  background: rgba(255, 255, 255, 0.72);\n  backdrop-filter: blur(24px) saturate(150%);\n  box-shadow: 0 10px 15px -3px rgba(40, 40, 40, 0.1);\n  font-family: inherit;\n  font-size: 0.95rem;\n  line-height: 1;\n  color: #282828;\n  pointer-events: none;\n}\n.bravais-legend[hidden] {\n  display: none;\n}\n.bravais-legend-item {\n  display: flex;\n  align-items: center;\n  gap: 8px;\n}\n.bravais-legend-swatch {\n  width: 18px;\n  height: 18px;\n  border-radius: 50%;\n  border: 1px solid rgba(40, 40, 40, 0.1);\n  box-shadow: 0 1px 2px rgba(0, 0, 0, 0.08);\n}\n";
-function Qr(e) {
-	if (e.getElementById(Xr)) return;
+var _i = "bravais-styles", vi = "\n.bravais-viewer {\n  position: relative;\n  overflow: hidden;\n}\n.bravais-canvas {\n  position: absolute;\n  inset: 0;\n  width: 100%;\n  height: 100%;\n  display: block;\n  touch-action: none;\n}\n.bravais-legend {\n  position: absolute;\n  left: 50%;\n  bottom: 20px;\n  transform: translateX(-50%);\n  display: flex;\n  flex-wrap: wrap;\n  justify-content: center;\n  gap: 8px 16px;\n  max-width: calc(100% - 32px);\n  padding: 8px 16px;\n  border: 1px solid rgba(40, 40, 40, 0.1);\n  border-radius: 999px;\n  background: rgba(255, 255, 255, 0.72);\n  backdrop-filter: blur(24px) saturate(150%);\n  box-shadow: 0 10px 15px -3px rgba(40, 40, 40, 0.1);\n  font-family: inherit;\n  font-size: 0.95rem;\n  line-height: 1;\n  color: #282828;\n  pointer-events: none;\n}\n.bravais-legend[hidden] {\n  display: none;\n}\n.bravais-legend-item {\n  display: flex;\n  align-items: center;\n  gap: 8px;\n}\n.bravais-legend-swatch {\n  width: 18px;\n  height: 18px;\n  border-radius: 50%;\n  border: 1px solid rgba(40, 40, 40, 0.1);\n  box-shadow: 0 1px 2px rgba(0, 0, 0, 0.08);\n}\n";
+function yi(e) {
+	if (e.getElementById(_i)) return;
 	let t = e.createElement("style");
-	t.id = Xr, t.textContent = Zr, e.head.appendChild(t);
+	t.id = _i, t.textContent = vi, e.head.appendChild(t);
 }
-function $r(e) {
+function bi(e) {
 	return `linear-gradient(135deg, rgba(255, 255, 255, 0.38) 0 14%, rgba(255, 255, 255, 0) 42%), ${e}`;
 }
-var ei = class {
+var xi = class {
 	element;
 	constructor(e) {
 		this.element = e.createElement("div"), this.element.className = "bravais-legend", this.element.hidden = !0;
@@ -1720,17 +1903,17 @@ var ei = class {
 			let e = this.element.ownerDocument.createElement("span");
 			e.className = "bravais-legend-item";
 			let n = this.element.ownerDocument.createElement("span");
-			n.className = "bravais-legend-swatch", n.style.background = $r(qr(t));
+			n.className = "bravais-legend-swatch", n.style.background = bi(mi(t));
 			let r = this.element.ownerDocument.createElement("span");
 			r.textContent = t, e.append(n, r), this.element.appendChild(e);
 		}
 		this.element.hidden = e.length === 0;
 	}
-}, Q = .4, $ = .1, ti = .398, ni = Math.sqrt(ti * ti - $ * $), ri = new M(0, 1, 0);
-function ii(e) {
-	let [t, n, r] = e.map((e) => new M(...e));
+}, $ = .4, Si = .1, Ci = .398, wi = Math.sqrt(Ci * Ci - Si * Si), Ti = new O(0, 1, 0);
+function Ei(e) {
+	let [t, n, r] = e.map((e) => new O(...e));
 	return [
-		new M(),
+		new O(),
 		t.clone(),
 		n.clone(),
 		r.clone(),
@@ -1740,7 +1923,7 @@ function ii(e) {
 		t.clone().add(n).add(r)
 	];
 }
-function ai(e) {
+function Di(e) {
 	let [t, n, r] = e;
 	return [
 		(t[0] + n[0] + r[0]) / 2,
@@ -1748,7 +1931,7 @@ function ai(e) {
 		(t[2] + n[2] + r[2]) / 2
 	];
 }
-var oi = [
+var Oi = [
 	[0, 1],
 	[0, 2],
 	[0, 3],
@@ -1762,107 +1945,106 @@ var oi = [
 	[5, 7],
 	[6, 7]
 ];
-function si(e, t) {
-	let n = ii(e), r = [];
-	for (let [e, t] of oi) {
+function ki(e, t) {
+	let n = Ei(e), r = [];
+	for (let [e, t] of Oi) {
 		let i = n[e], a = n[t];
 		r.push(i.x, i.y, i.z, a.x, a.y, a.z);
 	}
 	let i = new a();
-	return i.setAttribute("position", new h(r, 3)), new b(i, Wn(t));
+	return i.setAttribute("position", new h(r, 3)), new te(i, dr(t));
 }
-function ci(e) {
-	let t = 2048, n = Math.max(1, Math.ceil(e.length / 256)), r = new Float32Array(t * n * 4).fill(1), i = new s(Pn), a = new s(), o = !1;
+function Ai(e) {
+	let t = 2048, n = Math.max(1, Math.ceil(e.length / 256)), r = new Float32Array(t * n * 4).fill(1), i = new s(tr), a = new s(), o = !1;
 	e.forEach((e, n) => {
 		let s = Math.floor(n / 256), c = n % 256 * 8, l = (s * t + c) * 4, u = 0, d = Math.min(1, e.species[0]?.occupancy ?? 1);
-		for (let t of e.species.slice(1)) u < 7 && (a.set(qr(t.element)).toArray(r, l), r[l + 3] = d, l += 4, u += 1), d = Math.min(1, d + t.occupancy);
+		for (let t of e.species.slice(1)) u < 7 && (a.set(mi(t.element)).toArray(r, l), r[l + 3] = d, l += 4, u += 1), d = Math.min(1, d + t.occupancy);
 		d < 1 - 1e-6 && (i.toArray(r, l), r[l + 3] = d + 2, o = !0);
 	});
-	let c = new d(r, t, n, ie, g);
-	return c.magFilter = E, c.minFilter = E, c.generateMipmaps = !1, c.needsUpdate = !0, {
+	let c = new d(r, t, n, ce, g);
+	return c.magFilter = C, c.minFilter = C, c.generateMipmaps = !1, c.needsUpdate = !0, {
 		texture: c,
 		hasVacancies: o
 	};
 }
-function li() {
+function ji() {
 	let e = /* @__PURE__ */ new Map();
 	return (t) => {
 		let n = e.get(t);
-		return n || (n = new s(qr(t)), e.set(t, n)), n;
+		return n || (n = new s(mi(t)), e.set(t, n)), n;
 	};
 }
-function ui(e, t, n = li()) {
-	let r = new re(2, 2), i = ci(e), a = new v(r, Bn(t, i.texture, i.hasVacancies), e.length), o = new C();
+function Mi(e, t, n = ji()) {
+	let r = new se(2, 2), i = Ai(e), a = new v(r, sr(t, i.texture, i.hasVacancies), e.length), o = new ae();
 	return e.forEach((e, t) => {
-		o.makeScale(Q, Q, Q), o.setPosition(e.position[0], e.position[1], e.position[2]), a.setMatrixAt(t, o), a.setColorAt(t, n(e.element));
+		o.makeScale($, $, $), o.setPosition(e.position[0], e.position[1], e.position[2]), a.setMatrixAt(t, o), a.setColorAt(t, n(e.element));
 	}), a.instanceMatrix.needsUpdate = !0, a.instanceColor && (a.instanceColor.needsUpdate = !0), a.userData.sectorTexture = i.texture, a;
 }
-function di(e, t, n = li()) {
+function Ni(e, t, n = ji()) {
 	if (e.bonds.length === 0) return null;
-	let r = new i(2, 1, 2), a = new v(r, Un(t, ti), e.bonds.length * 2), o = new O(), s = new M(), c = new M(), l = new M(), u = new A();
+	let r = new i(2, 1, 2), a = new v(r, ur(t, Ci), e.bonds.length * 2), o = new w(), s = new O(), c = new O(), l = new O(), u = new E();
 	return e.bonds.forEach((t, r) => {
 		let i = e.atoms[t.start], d = e.atoms[t.end];
 		s.set(...i.position), c.set(...d.position), l.subVectors(c, s);
 		let f = l.length() / 2;
-		l.normalize(), u.setFromUnitVectors(ri, l);
+		l.normalize(), u.setFromUnitVectors(Ti, l);
 		let p = [[
 			0,
 			i,
-			ni,
+			wi,
 			f
 		], [
 			1,
 			d,
 			f,
-			2 * f - ni
+			2 * f - wi
 		]];
 		for (let [e, t, i, c] of p) {
 			let d = Math.max(0, c - i);
-			o.position.copy(s).addScaledVector(l, i + d / 2), o.quaternion.copy(u), o.scale.set($, d, $), o.updateMatrix(), a.setMatrixAt(r * 2 + e, o.matrix), a.setColorAt(r * 2 + e, n(t.element));
+			o.position.copy(s).addScaledVector(l, i + d / 2), o.quaternion.copy(u), o.scale.set(Si, d, Si), o.updateMatrix(), a.setMatrixAt(r * 2 + e, o.matrix), a.setColorAt(r * 2 + e, n(t.element));
 		}
 	}), a.instanceMatrix.needsUpdate = !0, a.instanceColor && (a.instanceColor.needsUpdate = !0), a;
 }
-function fi(e) {
+function Pi(e) {
 	let t = e[0];
 	if (!t) throw Error("A scene model needs at least one layer.");
-	Kr(e.flatMap((e) => [...e.scene.elements, ...e.scene.atoms.map((e) => e.element)]));
-	let n = ai(t.scene.cell), i = new _();
+	pi(e.flatMap((e) => [...e.scene.elements, ...e.scene.atoms.map((e) => e.element)]));
+	let n = Di(t.scene.cell), i = new _();
 	i.position.set(-n[0], -n[1], -n[2]);
-	let a = new r(), o = [], s = 1, c = [], l = new M(...n), u = new M(), d = new M();
+	let a = new r(), o = [], s = 1, c = [], l = new O(...n), u = new O(), d = new O();
 	for (let t of e) {
-		for (let e of ii(t.scene.cell)) a.expandByPoint(e.sub(l));
-		for (let e of t.scene.atoms) u.set(...e.position).sub(l), a.expandByPoint(d.copy(u).addScalar(Q)), a.expandByPoint(d.copy(u).subScalar(Q));
+		for (let e of Ei(t.scene.cell)) a.expandByPoint(e.sub(l));
+		for (let e of t.scene.atoms) u.set(...e.position).sub(l), a.expandByPoint(d.copy(u).addScalar($)), a.expandByPoint(d.copy(u).subScalar($));
 		for (let e of t.scene.cell) s = Math.max(s, Math.hypot(...e));
 		let e = t.opacity ?? 1;
 		if (e <= 0) continue;
-		let n = ui(t.scene.atoms, e);
+		let n = Mi(t.scene.atoms, e);
 		i.add(n), c.push(n);
-		let r = di(t.scene, e);
+		let r = Ni(t.scene, e);
 		r && (i.add(r), c.push(r));
-		let f = si(t.scene.cell, e);
+		let f = ki(t.scene.cell, e);
 		i.add(f), c.push(f);
 		for (let e of t.scene.elements) o.includes(e) || o.push(e);
 	}
 	return {
 		group: i,
 		cell: t.scene.cell,
-		center: n,
 		bounds: a,
 		span: s,
 		elements: o,
 		dispose() {
-			pi(c), i.clear();
+			Fi(c), i.clear();
 		}
 	};
 }
-function pi(e) {
+function Fi(e) {
 	for (let t of e) {
 		t.geometry.dispose();
 		let e = t.userData.sectorTexture;
 		e instanceof d && e.dispose();
 	}
 }
-var mi = {
+var Ii = {
 	cell: [
 		[
 			1,
@@ -1906,124 +2088,124 @@ var mi = {
 	}],
 	elements: []
 };
-function hi() {
+function Li() {
 	let e = new s("#ffffff"), t = [];
-	for (let n of [1, .5]) t.push(ui(mi.atoms, n, () => e), di(mi, n, () => e));
-	t.push(si(mi.cell, 1));
+	for (let n of [1, .5]) t.push(Mi(Ii.atoms, n, () => e), Ni(Ii, n, () => e));
+	t.push(ki(Ii.cell, 1));
 	let n = new _();
 	return n.add(...t), {
 		group: n,
-		dispose: () => pi(t)
+		dispose: () => Fi(t)
 	};
 }
 //#endregion
 //#region src/render/stage.ts
-function gi(t = {}) {
-	let r = new N({
+function Ri(t = {}) {
+	let r = new he({
 		antialias: !0,
 		alpha: !0,
 		stencil: t.stencil ?? !1
 	});
-	r.setClearColor(Mn, 1), r.toneMapping = e;
-	let i = new se(), a = new k(-1, 1, 1, -1, .01, 1e3), o = new f("#ffffff", An);
-	i.add(new n("#ffffff", kn), o, o.target);
-	let s = new M();
+	r.setClearColor($n, 1), r.toneMapping = e;
+	let i = new de(), a = new T(-1, 1, 1, -1, .01, 1e3), o = new f("#ffffff", Zn);
+	i.add(new n("#ffffff", Xn), o, o.target);
+	let s = new O();
 	return {
 		renderer: r,
 		scene: i,
 		camera: a,
 		updateHeadlight() {
 			let e = Math.max(a.position.length(), 4);
-			s.set(...jn).multiplyScalar(e).applyQuaternion(a.quaternion), o.position.copy(a.position).add(s);
+			s.set(...Qn).multiplyScalar(e).applyQuaternion(a.quaternion), o.position.copy(a.position).add(s);
 		}
 	};
 }
 //#endregion
 //#region src/render/viewer.ts
-var _i = .4, vi = .4, yi = .4, bi = 2, xi = 1.2, Si = .2, Ci = 1500, wi = .2, Ti = 5, Ei = 3, Di = 1e-5, Oi = 4, ki = .35, Ai = 110, ji = 180;
-function Mi(e, t, n) {
-	let r = new M(0, 0, 1).applyQuaternion(n), i = 0, a = 0, o = new M();
+var zi = .4, Bi = .4, Vi = .4, Hi = 2, Ui = 1.2, Wi = .2, Gi = 1500, Ki = .2, qi = 5, Ji = 3, Yi = 1e-5, Xi = 4, Zi = .35, Qi = 110, $i = 180;
+function ea(e, t, n) {
+	let r = new O(0, 0, 1).applyQuaternion(n), i = 0, a = 0, o = new O();
 	for (let t of [e.bounds.min.x, e.bounds.max.x]) for (let n of [e.bounds.min.y, e.bounds.max.y]) for (let s of [e.bounds.min.z, e.bounds.max.z]) {
 		let e = o.set(t, n, s).dot(r);
 		i = Math.max(i, e), a = Math.min(a, e);
 	}
-	let s = Math.max(1, e.span), c = Math.max(.01 * s, -a), l = Math.min(c, -i), u = s * yi, d = l - u, f = t + (d + (Math.max(d, c - u) - d) * vi), p = f + (t + c - f) / _i;
-	return new ee(Mn, f, p);
+	let s = Math.max(1, e.span), c = Math.max(.01 * s, -a), l = Math.min(c, -i), u = s * Vi, d = l - u, f = t + (d + (Math.max(d, c - u) - d) * Bi), p = f + (t + c - f) / zi;
+	return new ee($n, f, p);
 }
-function Ni(e, t = {}) {
+function ta(e, t = {}) {
 	let n = e.ownerDocument;
-	Qr(n), e.classList.add("bravais-viewer");
-	let { renderer: r, scene: i, camera: a, updateHeadlight: o } = gi({ stencil: !0 });
+	yi(n), e.classList.add("bravais-viewer");
+	let { renderer: r, scene: i, camera: a, updateHeadlight: o } = Ri({ stencil: !0 });
 	r.setPixelRatio(n.defaultView?.devicePixelRatio ?? 1), r.domElement.className = "bravais-canvas", e.appendChild(r.domElement);
-	let s = t.legend === !1 ? null : new ei(n);
+	let s = t.legend === !1 ? null : new xi(n);
 	s && e.appendChild(s.element);
-	let c = n.defaultView?.getComputedStyle(e).fontFamily ?? "sans-serif", l = t.gizmo === !1 ? null : new sr(c), u = new Jt(a, r.domElement);
-	u.rotateSpeed = bi, u.zoomSpeed = xi, u.dynamicDampingFactor = Si, u.staticMoving = !1, u.noPan = !0, u.mouseButtons.LEFT = S.ROTATE, u.mouseButtons.MIDDLE = S.DOLLY, u.mouseButtons.RIGHT = null;
-	let d = null, f = null, p = 4, m = 1, h = 1, g = 1, _ = null, v = !1, y = 0, b = !1, x = 0, te = !1, ne = new j(), C = new A(), w = 0, T = new M(), E = /* @__PURE__ */ new Set();
-	function D() {
-		x = 0, te = !1;
-		for (let e of E) e();
-	}
-	function O() {
+	let c = n.defaultView?.getComputedStyle(e).fontFamily ?? "sans-serif", l = t.gizmo === !1 ? null : new Or(c), u = new gn(a, r.domElement);
+	u.rotateSpeed = Hi, u.zoomSpeed = Ui, u.dynamicDampingFactor = Wi, u.staticMoving = !1, u.noPan = !0, u.mouseButtons.LEFT = b.ROTATE, u.mouseButtons.MIDDLE = b.DOLLY, u.mouseButtons.RIGHT = null;
+	let d = null, f = null, p = 4, m = 1, h = 1, g = 1, _ = null, v = !1, y = 0, te = !1, ne = 0, re = !1, ie = new D(), ae = new E(), x = 0, S = new O(), C = /* @__PURE__ */ new Set();
+	function oe() {
+		ne = 0, re = !1;
+		for (let e of C) e();
+	}
+	function w() {
 		if (!f && (o(), r.setViewport(0, 0, h, g), r.render(i, a), l && d)) {
-			let e = Math.round(Math.min(ji, Math.max(Ai, Math.min(h, g) * ki)));
+			let e = Math.round(Math.min($i, Math.max(Qi, Math.min(h, g) * Zi)));
 			l.render(r, a.quaternion, e);
 		}
 	}
-	function k() {
+	function T() {
 		let t = e.getBoundingClientRect();
 		h = Math.max(1, Math.round(t.width)), g = Math.max(1, Math.round(t.height));
-		let n = r.getSize(ne);
-		(n.x !== h || n.y !== g) && r.setSize(h, g, !1), En(a, h, g), u.handleResize(), u.rotateSpeed = h / Ci * bi;
+		let n = r.getSize(ie);
+		(n.x !== h || n.y !== g) && r.setSize(h, g, !1), qn(a, h, g), u.handleResize(), u.rotateSpeed = h / Gi * Hi;
 	}
-	function re(e) {
-		d && (m = Tn(d.bounds, e, h, g), u.minZoom = m * wi, u.maxZoom = m * Ti);
+	function se(e) {
+		d && (m = Kn(d.bounds, e, h, g), u.minZoom = m * Ki, u.maxZoom = m * qi);
 	}
-	function ie() {
-		let e = C.angleTo(a.quaternion) > Di || Math.abs(w - a.zoom) > Di * m || T.distanceToSquared(u.target) > Di;
-		return C.copy(a.quaternion), w = a.zoom, T.copy(u.target), e;
+	function ce() {
+		let e = ae.angleTo(a.quaternion) > Yi || Math.abs(x - a.zoom) > Yi * m || S.distanceToSquared(u.target) > Yi;
+		return ae.copy(a.quaternion), x = a.zoom, S.copy(u.target), e;
 	}
-	function ae() {
-		_ = null, u.update(), ie() ? (y = 0, O(), x += 1, te = !0, x >= Oi && D()) : y += 1, b || y < Ei ? _ = requestAnimationFrame(ae) : (v = !1, te && D());
+	function le() {
+		_ = null, u.update(), ce() ? (y = 0, w(), ne += 1, re = !0, ne >= Xi && oe()) : y += 1, te || y < Ji ? _ = requestAnimationFrame(le) : (v = !1, re && oe());
 	}
-	function oe() {
-		y = 0, v || (v = !0, _ = requestAnimationFrame(ae));
+	function ue() {
+		y = 0, v || (v = !0, _ = requestAnimationFrame(le));
 	}
-	function se() {
+	function de() {
 		_ !== null && (cancelAnimationFrame(_), _ = null), v = !1;
 	}
 	u.addEventListener("start", () => {
-		b = !0, oe();
+		te = !0, ue();
 	}), u.addEventListener("end", () => {
-		b = !1, oe();
-	}), u.addEventListener("change", oe);
-	function ce() {
+		te = !1, ue();
+	}), u.addEventListener("change", ue);
+	function fe() {
 		let e = m > 0 ? a.zoom / m : 1;
-		k(), re(a.quaternion), a.zoom = m * e, a.updateProjectionMatrix(), O();
-	}
-	let le = typeof ResizeObserver > "u" ? null : new ResizeObserver(ce);
-	le?.observe(e), k();
-	let ue = hi();
-	i.add(ue.group), i.fog = new ee(Mn, 1, 2);
-	let N = Promise.all([r.compileAsync(i, a), l && r.compileAsync(l.scene, l.camera)]);
-	i.remove(ue.group), i.fog = null, ue.dispose(), f = N;
-	let P = () => {
-		f === N && (f = null, O());
+		T(), se(a.quaternion), a.zoom = m * e, a.updateProjectionMatrix(), w();
+	}
+	let pe = typeof ResizeObserver > "u" ? null : new ResizeObserver(fe);
+	pe?.observe(e), T();
+	let me = Li();
+	i.add(me.group), i.fog = new ee($n, 1, 2);
+	let he = Promise.all([r.compileAsync(i, a), l && r.compileAsync(l.scene, l.camera)]);
+	i.remove(me.group), i.fog = null, me.dispose(), f = he;
+	let k = () => {
+		f === he && (f = null, w());
 	};
-	N.then(P, P);
-	function F(e) {
-		d && (Sn(a, e, p, d.span), u.target.set(...e.target), re(a.quaternion), a.zoom = m * e.scale, a.updateProjectionMatrix(), u.update(), ie());
+	he.then(k, k);
+	function A(e) {
+		d && (Un(a, e, p, d.span), u.target.set(...e.target), se(a.quaternion), a.zoom = m * e.scale, a.updateProjectionMatrix(), u.update(), ce());
 	}
-	let de = {
+	let j = {
 		setLayers(e, t = null) {
-			de.clear(), e.length !== 0 && (d = fi(e), i.add(d.group), p = yn(d.span), i.fog = Mi(d, p, bn(d.cell)), s?.setElements(d.elements), l?.setCell(d.cell), k(), F(t ?? xn(d.cell)), O());
+			j.clear(), e.length !== 0 && (d = Pi(e), i.add(d.group), p = Bn(d.span), i.fog = ea(d, p, Vn(d.cell)), s?.setElements(d.elements), l?.setCell(d.cell), T(), A(t ?? Hn(d.cell)), w());
 		},
 		clear() {
-			se(), d &&= (i.remove(d.group), d.dispose(), null), i.fog = null, s?.setElements([]), r.setViewport(0, 0, h, g), r.clear();
+			de(), d &&= (i.remove(d.group), d.dispose(), null), i.fog = null, s?.setElements([]), r.setViewport(0, 0, h, g), r.clear();
 		},
 		getView() {
 			return d ? {
-				quaternion: Cn(a.quaternion),
+				quaternion: Wn(a.quaternion),
 				target: [
 					u.target.x,
 					u.target.y,
@@ -2033,32 +2215,32 @@ function Ni(e, t = {}) {
 			} : null;
 		},
 		setView(e) {
-			F(e), O();
+			A(e), w();
 		},
 		resetView() {
-			d && F(xn(d.cell)), O(), D();
+			d && A(Hn(d.cell)), w(), oe();
 		},
-		resize: ce,
-		render: O,
+		resize: fe,
+		render: w,
 		onInteraction(e) {
-			return E.add(e), () => E.delete(e);
+			return C.add(e), () => C.delete(e);
 		},
 		dispose() {
-			de.clear(), f = null, b = !1, le?.disconnect(), u.dispose(), l?.dispose(), r.dispose(), r.domElement.remove(), s?.element.remove(), e.classList.remove("bravais-viewer");
+			j.clear(), f = null, pe?.disconnect(), u.dispose(), l?.dispose(), r.dispose(), r.domElement.remove(), s?.element.remove(), e.classList.remove("bravais-viewer");
 		}
 	};
-	return de;
+	return j;
 }
 //#endregion
 //#region src/render/thumbnails.ts
-function Pi() {
-	let { renderer: e, scene: t, camera: n, updateHeadlight: r } = gi(), i = /* @__PURE__ */ new Map(), a = hi();
+function na() {
+	let { renderer: e, scene: t, camera: n, updateHeadlight: r } = Ri(), i = /* @__PURE__ */ new Map(), a = Li();
 	t.add(a.group), e.compile(t, n), t.remove(a.group), a.dispose();
 	function o(e, t) {
 		let n = i.get(e);
 		if (n && n.layers === t) return n.model;
 		n?.model.dispose();
-		let r = fi(t);
+		let r = Pi(t);
 		return i.set(e, {
 			layers: t,
 			model: r
@@ -2069,9 +2251,9 @@ function Pi() {
 			let l = c.getContext("2d");
 			if (!l || a.length === 0) return;
 			let u = o(i, a), d = Math.max(1, c.width), f = Math.max(1, c.height);
-			(e.domElement.width !== d || e.domElement.height !== f) && e.setSize(d, f, !1), En(n, d, f);
-			let p = yn(u.span), m = s ?? xn(u.cell);
-			Sn(n, m, p, u.span), n.zoom = Tn(u.bounds, new A(...m.quaternion), d, f) * m.scale, n.updateProjectionMatrix(), r(), t.add(u.group), e.render(t, n), t.remove(u.group), l.clearRect(0, 0, d, f), l.drawImage(e.domElement, 0, 0, d, f);
+			(e.domElement.width !== d || e.domElement.height !== f) && e.setSize(d, f, !1), qn(n, d, f);
+			let p = Bn(u.span), m = s ?? Hn(u.cell);
+			Un(n, m, p, u.span), n.zoom = Kn(u.bounds, new E(...m.quaternion), d, f) * m.scale, n.updateProjectionMatrix(), r(), t.add(u.group), e.render(t, n), t.remove(u.group), l.clearRect(0, 0, d, f), l.drawImage(e.domElement, 0, 0, d, f);
 		},
 		release(e) {
 			i.get(e)?.model.dispose(), i.delete(e);
@@ -2084,18 +2266,18 @@ function Pi() {
 }
 //#endregion
 //#region src/index.ts
-async function Fi(e) {
-	let t = ge(e), n = t.blocks.find(Ye) ?? t.blocks[0];
-	if (!n) throw new H("The CIF has no data block.");
-	let r = Xe(n);
+async function ra(e) {
+	let t = Se(e), n = t.blocks.find(it) ?? t.blocks[0];
+	if (!n) throw new M("The CIF has no data block.");
+	let r = at(n);
 	return {
 		lattice: r.lattice,
 		sites: r.sites,
-		operations: await _t(r),
+		operations: await Dt(r, M),
 		spaceGroup: r.spaceGroup
 	};
 }
 //#endregion
-export { H as CifStructureError, P as CifSyntaxError, nt as SpaceGroupLookupError, bt as SymmetryAnalysisError, Ft as buildScene, Pi as createThumbnailRenderer, Ni as createViewer, qr as elementColor, Jr as elementColorAssignments, Kr as ensureElementColors, rt as ensureMoyo, vt as expandStructure, Me as latticeFromParameters, Ne as latticeFromVectors, dt as operationsForSpaceGroup, ge as parseCif, Xe as parseCifStructure, Re as parseSymmetryOperator, Fi as readCif, Yr as resetElementColors, Pt as structureElements, Ct as symmetryDataset, Dt as typesetSymbol };
+export { M as CifStructureError, j as CifSyntaxError, ft as SpaceGroupLookupError, A as StructureDataError, k as StructureError, Ht as SymmetryAnalysisError, rn as buildScene, na as createThumbnailRenderer, ta as createViewer, mi as elementColor, hi as elementColorAssignments, pi as ensureElementColors, pt as ensureMoyo, Bt as expandStructure, Me as latticeFromParameters, Ne as latticeFromVectors, xt as operationsForSpaceGroup, Se as parseCif, at as parseCifStructure, Xe as parseSymmetryOperation, ra as readCif, zt as readStructure, gi as resetElementColors, nn as structureElements, Gt as symmetryDataset, Yt as typesetSymbol };
 
 //# sourceMappingURL=bravais.js.map