molstar 3.0.0 → 3.0.1

package/lib/commonjs/mol-io/reader/cif/schema/cif-core.js

@@ -1,750 +0,0 @@
-"use strict";
-/**
- * Copyright (c) 2017-2020 mol* contributors, licensed under MIT, See LICENSE file for more info.
- *
- * Code-generated 'CifCore' schema file. Dictionary versions: CifCore 3.1.0.
- *
- * @author molstar/ciftools package
- */
-Object.defineProperty(exports, "__esModule", { value: true });
-exports.CifCore_Aliases = exports.CifCore_Schema = void 0;
-var db_1 = require("../../../../mol-data/db");
-var Schema = db_1.Column.Schema;
-var float = Schema.float;
-var int = Schema.int;
-var str = Schema.str;
-var Matrix = Schema.Matrix;
-exports.CifCore_Schema = {
-    /**
-     * The CATEGORY of data items used to describe the parameters of
-     * the crystal unit cell and their measurement.
-     */
-    cell: {
-        /**
-         * The angle between the bounding cell axes.
-         */
-        angle_alpha: float,
-        /**
-         * The angle between the bounding cell axes.
-         */
-        angle_beta: float,
-        /**
-         * The angle between the bounding cell axes.
-         */
-        angle_gamma: float,
-        /**
-         * The number of the formula units in the unit cell as specified
-         * by _chemical_formula.structural, _chemical_formula.moiety or
-         * _chemical_formula.sum.
-         */
-        formula_units_z: int,
-        /**
-         * The length of each cell axis.
-         */
-        length_a: float,
-        /**
-         * The length of each cell axis.
-         */
-        length_b: float,
-        /**
-         * The length of each cell axis.
-         */
-        length_c: float,
-        /**
-         * Volume of the crystal unit cell.
-         */
-        volume: float,
-    },
-    /**
-     * The CATEGORY of data items which describe the composition and
-     * chemical properties of the compound under study. The formula data
-     * items must be consistent with the density, unit-cell and Z values.
-     */
-    chemical: {
-        /**
-         * The temperature at which a crystalline solid changes to a liquid.
-         */
-        melting_point: float,
-        /**
-         * Trivial name by which the compound is commonly known.
-         */
-        name_common: str,
-        /**
-         * IUPAC or Chemical Abstracts full name of compound.
-         */
-        name_systematic: str,
-    },
-    /**
-     * The CATEGORY of data items which specify the composition and chemical
-     * properties of the compound. The formula data items must agree
-     * with those that specify the density, unit-cell and Z values.
-     *
-     * The following rules apply to the construction of the data items
-     * _chemical_formula.analytical, *.structural and *.sum. For the
-     * data item *.moiety the formula construction is broken up into
-     * residues or moieties, i.e. groups of atoms that form a molecular
-     * unit or molecular ion. The  rules given below apply within each
-     * moiety but different requirements apply to the way that moieties
-     * are connected (see _chemical_formula.moiety).
-     *
-     * 1. Only recognized element symbols may be used.
-     *
-     * 2. Each element symbol is followed by a 'count' number. A count of
-     * '1' may be omitted.
-     *
-     * 3. A space or parenthesis must separate each cluster of (element
-     * symbol + count).
-     *
-     * 4. Where a group of elements is enclosed in parentheses, the
-     * multiplier for the group must follow the closing parentheses.
-     * That is, all element and group multipliers are assumed to be
-     * printed as subscripted numbers. [An exception to this rule
-     * exists for *.moiety formulae where pre- and post-multipliers
-     * are permitted for molecular units].
-     *
-     * 5. Unless the elements are ordered in a manner that corresponds to
-     * their chemical structure, as in _chemical_formula.structural,
-     * the order of the elements within any group or moiety
-     * depends on whether or not carbon is present. If carbon is
-     * present, the order should be: C, then H, then the other
-     * elements in alphabetical order of their symbol. If carbon is
-     * not present, the elements are listed purely in alphabetic order
-     * of their symbol. This is the 'Hill' system used by Chemical
-     * Abstracts. This ordering is used in _chemical_formula.moiety
-     * and _chemical_formula.sum.
-     *
-     * _chemical_formula.IUPAC      '[Mo (C O)4 (C18 H33 P)2]'
-     * _chemical_formula.moiety     'C40 H66 Mo O4 P2'
-     * _chemical_formula.structural '((C O)4 (P (C6 H11)3)2)Mo'
-     * _chemical_formula.sum         'C40 H66 Mo O4 P2'
-     * _chemical_formula.weight      768.81
-     */
-    chemical_formula: {
-        /**
-         * Formula with each discrete bonded residue or ion shown as a
-         * separate moiety. See above CHEMICAL_FORMULA for rules
-         * for writing chemical formulae. In addition to the general
-         * formulae requirements, the following rules apply:
-         * 1. Moieties are separated by commas ','.
-         * 2. The order of elements within a moiety follows general rule
-         * 5 in CHEMICAL_FORMULA.
-         * 3. Parentheses are not used within moieties but may surround
-         * a moiety. Parentheses may not be nested.
-         * 4. Charges should be placed at the end of the moiety. The
-         * Singlege '+' or '-' may be preceded by a numerical multiplier
-         * and should be separated from the last (element symbol +
-         * count) by a space. Pre- or post-multipliers may be used for
-         * individual moieties.
-         */
-        moiety: str,
-        /**
-         * Chemical formulae in which all discrete bonded residues and ions are
-         * summed over the constituent elements, following the ordering given
-         * in rule 5 of the CATEGORY description. Parentheses normally not used.
-         */
-        sum: str,
-        /**
-         * Mass corresponding to the formulae _chemical_formula.structural,
-         * *_IUPAC, *_moiety or *_sum and, together with the Z value and cell
-         * parameters yield the density given as _exptl_crystal.density_diffrn.
-         */
-        weight: float,
-    },
-    /**
-     * The CATEGORY of data items used to specify space group
-     * information about the crystal used in the diffraction measurements.
-     *
-     * Space-group types are identified by their number as listed in
-     * International Tables for Crystallography Volume A, or by their
-     * Schoenflies symbol. Specific settings of the space groups can
-     * be identified by their Hall symbol, by specifying their
-     * symmetry operations or generators, or by giving the
-     * transformation that relates the specific setting to the
-     * reference setting based on International Tables Volume A and
-     * stored in this dictionary.
-     *
-     * The commonly used Hermann-Mauguin symbol determines the
-     * space-group type uniquely but several different Hermann-Mauguin
-     * symbols may refer to the same space-group type. A
-     * Hermann-Mauguin symbol contains information on the choice of
-     * the basis, but not on the choice of origin.
-     *
-     * Ref: International Tables for Crystallography (2002). Volume A,
-     * Space-group symmetry, edited by Th. Hahn, 5th ed.
-     * Dordrecht: Kluwer Academic Publishers.
-     */
-    space_group: {
-        /**
-         * The name of the system of geometric crystal classes of space
-         * groups (crystal system) to which the space group belongs.
-         * Note that rhombohedral space groups belong to the
-         * trigonal system.
-         */
-        crystal_system: str,
-        /**
-         * The number as assigned in International Tables for Crystallography
-         * Vol. A, specifying the proper affine class (i.e. the orientation
-         * preserving affine class) of space groups (crystallographic space
-         * group type) to which the space group belongs. This number defines
-         * the space group type but not the coordinate system expressed.
-         */
-        it_number: int,
-        /**
-         * The full international Hermann-Mauguin space-group symbol as
-         * defined in Section 2.2.3 and given as the second item of the
-         * second line of each of the space-group tables of Part 7 of
-         * International Tables for Crystallography Volume A (2002).
-         *
-         * Each component of the space-group name is separated by a
-         * space or an underscore character. The use of a space is
-         * strongly recommended.  The underscore is only retained
-         * because it was used in old CIFs. It should not be used in
-         * new CIFs.
-         *
-         * Subscripts should appear without special symbols. Bars should
-         * be given as negative signs before the numbers to which they
-         * apply. The commonly used Hermann-Mauguin symbol determines the
-         * space-group type uniquely but a given space-group type may
-         * be described by more than one Hermann-Mauguin symbol. The
-         * space-group type is best described using
-         * _space_group.IT_number or _space_group.name_Schoenflies. The
-         * full international Hermann-Mauguin symbol contains information
-         * about the choice of basis for monoclinic and orthorhombic
-         * space groups but does not give information about the choice
-         * of origin. To define the setting uniquely use
-         * _space_group.name_Hall, or list the symmetry operations
-         * or generators.
-         *
-         * Ref: International Tables for Crystallography (2002). Volume A,
-         * Space-group symmetry, edited by Th. Hahn, 5th ed.
-         * Dordrecht: Kluwer Academic Publishers.
-         */
-        'name_h-m_full': str,
-    },
-    /**
-     * The CATEGORY of data items used to describe symmetry equivalent sites
-     * in the crystal unit cell.
-     */
-    space_group_symop: {
-        /**
-         * A parsable string giving one of the symmetry operations of the
-         * space group in algebraic form.  If W is a matrix representation
-         * of the rotational part of the symmetry operation defined by the
-         * positions and signs of x, y and z, and w is a column of
-         * translations defined by fractions, an equivalent position
-         * X' is generated from a given position X by the equation
-         *
-         * X' = WX + w
-         *
-         * (Note: X is used to represent bold_italics_x in International
-         * Tables for Crystallography Vol. A, Part 5)
-         *
-         * When a list of symmetry operations is given, it must contain
-         * a complete set of coordinate representatives which generates
-         * all the operations of the space group by the addition of
-         * all primitive translations of the space group. Such
-         * representatives are to be found as the coordinates of
-         * the general-equivalent position in International Tables for
-         * Crystallography Vol. A (2002), to which it is necessary to
-         * add any centring translations shown above the
-         * general-equivalent position.
-         *
-         * That is to say, it is necessary to list explicitly all the
-         * symmetry operations required to generate all the atoms in
-         * the unit cell defined by the setting used.
-         */
-        operation_xyz: str,
-    },
-    /**
-     * The CATEGORY of data items used to specify the geometry bonds in the
-     * structural model as derived from the atomic sites.
-     */
-    geom_bond: {
-        /**
-         * This label is a unique identifier for a particular site in the
-         * asymmetric unit of the crystal unit cell.
-         */
-        atom_site_label_1: str,
-        /**
-         * This label is a unique identifier for a particular site in the
-         * asymmetric unit of the crystal unit cell.
-         */
-        atom_site_label_2: str,
-        /**
-         * Intramolecular bond distance between the sites identified
-         * by _geom_bond.id
-         */
-        distance: float,
-        /**
-         * This code signals whether the angle is referred to in a
-         * publication or should be placed in a table of significant angles.
-         */
-        publ_flag: str,
-        /**
-         * The set of data items which specify the symmetry operation codes
-         * which must be applied to the atom sites involved in the geometry angle.
-         *
-         * The symmetry code of each atom site as the symmetry-equivalent position
-         * number 'n' and the cell translation number 'pqr'. These numbers are
-         * combined to form the code 'n pqr' or n_pqr.
-         *
-         * The character string n_pqr is composed as follows:
-         *
-         * n refers to the symmetry operation that is applied to the
-         * coordinates stored in _atom_site.fract_xyz. It must match a
-         * number given in _symmetry_equiv.pos_site_id.
-         *
-         * p, q and r refer to the translations that are subsequently
-         * applied to the symmetry transformed coordinates to generate
-         * the atom used in calculating the angle. These translations
-         * (x,y,z) are related to (p,q,r) by the relations
-         * p = 5 + x
-         * q = 5 + y
-         * r = 5 + z
-         */
-        site_symmetry_1: str,
-        /**
-         * The set of data items which specify the symmetry operation codes
-         * which must be applied to the atom sites involved in the geometry angle.
-         *
-         * The symmetry code of each atom site as the symmetry-equivalent position
-         * number 'n' and the cell translation number 'pqr'. These numbers are
-         * combined to form the code 'n pqr' or n_pqr.
-         *
-         * The character string n_pqr is composed as follows:
-         *
-         * n refers to the symmetry operation that is applied to the
-         * coordinates stored in _atom_site.fract_xyz. It must match a
-         * number given in _symmetry_equiv.pos_site_id.
-         *
-         * p, q and r refer to the translations that are subsequently
-         * applied to the symmetry transformed coordinates to generate
-         * the atom used in calculating the angle. These translations
-         * (x,y,z) are related to (p,q,r) by the relations
-         * p = 5 + x
-         * q = 5 + y
-         * r = 5 + z
-         */
-        site_symmetry_2: str,
-        /**
-         * Bond valence calculated from the bond distance.
-         */
-        valence: float,
-    },
-    /**
-     * The CATEGORY of data items used to record details about the
-     * creation and subsequent updating of the data block.
-     */
-    audit: {
-        /**
-         * The digital object identifier (DOI) registered to identify
-         * the data set publication represented by the current
-         * data block. This can be used as a unique identifier for
-         * the data block so long as the code used is a valid DOI
-         * (i.e. begins with a valid publisher prefix assigned by a
-         * Registration Agency and a suffix guaranteed to be unique
-         * by the publisher) and has had its metadata deposited
-         * with a DOI Registration Agency.
-         *
-         * A DOI is a unique character string identifying any
-         * object of intellectual property. It provides a
-         * persistent identifier for an object on a digital network
-         * and permits the association of related current data in a
-         * structured extensible way. A DOI is an implementation
-         * of the Internet concepts of Uniform Resource Name and
-         * Universal Resource Locator managed according to the
-         * specifications of the International DOI Foundation
-         * (see http://www.doi.org).
-         */
-        block_doi: str,
-    },
-    /**
-     * The CATEGORY of data items recording database deposition. These data items
-     * are assigned by database managers and should only appear in a CIF if they
-     * originate from that source.
-     */
-    database_code: {
-        /**
-         * Code assigned by the Crystallography Open Database (COD).
-         */
-        cod: str,
-        /**
-         * Code assigned by the Cambridge Structural Database.
-         */
-        csd: str,
-        /**
-         * Deposition numbers assigned by the Cambridge Crystallographic
-         * Data Centre (CCDC) to files containing structural information
-         * archived by the CCDC.
-         */
-        depnum_ccdc_archive: str,
-        /**
-         * Deposition numbers assigned by the Fachinformationszentrum
-         * Karlsruhe (FIZ) to files containing structural information
-         * archived by the Cambridge Crystallographic Data Centre (CCDC).
-         */
-        depnum_ccdc_fiz: str,
-        /**
-         * Code assigned by the Inorganic Crystal Structure Database.
-         */
-        icsd: str,
-        /**
-         * Code assigned in the Metals Data File.
-         */
-        mdf: str,
-        /**
-         * Code assigned by the NBS (NIST) Crystal Data Database.
-         */
-        nbs: str,
-    },
-    /**
-     * The CATEGORY of data items used to describe atom site information
-     * used in crystallographic structure studies.
-     */
-    atom_site: {
-        /**
-         * Code for type of atomic displacement parameters used for the site.
-         */
-        adp_type: str,
-        /**
-         * A standard code to signal if the site coordinates have been
-         * determined from the intensities or calculated from the geometry
-         * of surrounding sites, or have been assigned dummy coordinates.
-         */
-        calc_flag: str,
-        /**
-         * A code which identifies a cluster of atoms that show long range
-         * positional disorder but are locally ordered. Within each such
-         * cluster of atoms, _atom_site.disorder_group is used to identify
-         * the sites that are simultaneously occupied. This field is only
-         * needed if there is more than one cluster of disordered atoms
-         * showing independent local order.
-         */
-        disorder_assembly: str,
-        /**
-         * A code that identifies a group of positionally disordered atom
-         * sites that are locally simultaneously occupied. Atoms that are
-         * positionally disordered over two or more sites (e.g. the H
-         * atoms of a methyl group that exists in two orientations) can
-         * be assigned to two or more groups. Sites belonging to the same
-         * group are simultaneously occupied, but those belonging to
-         * different groups are not. A minus prefix (e.g. "-1") is used to
-         * indicate sites disordered about a special position.
-         */
-        disorder_group: str,
-        /**
-         * Atom site coordinates as fractions of the cell length values.
-         */
-        fract_x: float,
-        /**
-         * Atom site coordinates as fractions of the cell length values.
-         */
-        fract_y: float,
-        /**
-         * Atom site coordinates as fractions of the cell length values.
-         */
-        fract_z: float,
-        /**
-         * This label is a unique identifier for a particular site in the
-         * asymmetric unit of the crystal unit cell. It is made up of
-         * components, _atom_site.label_component_0 to *_6, which may be
-         * specified as separate data items. Component 0 usually matches one
-         * of the specified _atom_type.symbol codes. This is not mandatory
-         * if an _atom_site.type_symbol item is included in the atom site
-         * list. The _atom_site.type_symbol always takes precedence over
-         * an _atom_site.label in the identification of the atom type. The
-         * label components 1 to 6 are optional, and normally only
-         * components 0 and 1 are used. Note that components 0 and 1 are
-         * concatenated, while all other components, if specified, are
-         * separated by an underline character. Underline separators are
-         * only used if higher-order components exist. If an intermediate
-         * component is not used it may be omitted provided the underline
-         * separators are inserted. For example the label 'C233__ggg' is
-         * acceptable and represents the components C, 233, '', and ggg.
-         * Each label may have a different number of components.
-         */
-        label: str,
-        /**
-         * The fraction of the atom type present at this site.
-         * The sum of the occupancies of all the atom types at this site
-         * may not significantly exceed 1.0 unless it is a dummy site. The
-         * value must lie in the 99.97% Gaussian confidence interval
-         * -3u =< x =< 1 + 3u. The _enumeration.range of 0.0:1.0 is thus
-         * correctly interpreted as meaning (0.0 - 3u) =< x =< (1.0 + 3u).
-         */
-        occupancy: float,
-        /**
-         * A concatenated series of single-letter codes which indicate the
-         * refinement restraints or constraints applied to this site. This
-         * item should not be used. It has been replaced by
-         * _atom_site.refinement_flags_posn, _ADP and _occupancy. It is
-         * retained in this dictionary only to provide compatibility with
-         * legacy CIFs.
-         */
-        refinement_flags: str,
-        /**
-         * The number of different sites that are generated by the
-         * application of the space-group symmetry to the coordinates
-         * given for this site. It is equal to the multiplicity given
-         * for this Wyckoff site in International Tables for Cryst.
-         * Vol. A (2002). It is equal to the multiplicity of the general
-         * position divided by the order of the site symmetry given in
-         * _atom_site.site_symmetry_order.
-         */
-        site_symmetry_multiplicity: int,
-        /**
-         * A code to identify the atom specie(s) occupying this site.
-         * This code must match a corresponding _atom_type.symbol. The
-         * specification of this code is optional if component_0 of the
-         * _atom_site.label is used for this purpose. See _atom_type.symbol.
-         */
-        type_symbol: str,
-        /**
-         * Isotropic atomic displacement parameter, or equivalent isotropic
-         * atomic  displacement parameter, U(equiv), in angstroms squared,
-         * calculated from anisotropic atomic displacement  parameters.
-         *
-         * U(equiv) = (1/3) sum~i~[sum~j~(U^ij^ a*~i~ a*~j~ a~i~.a~j~)]
-         *
-         * a  = the real-space cell vectors
-         * a* = the reciprocal-space cell lengths
-         * Ref: Fischer, R. X. & Tillmanns, E. (1988). Acta Cryst. C44, 775-776.
-         */
-        u_iso_or_equiv: float,
-    },
-    /**
-     * The CATEGORY of data items used to describe the anisotropic
-     * thermal parameters of the atomic sites in a crystal structure.
-     */
-    atom_site_aniso: {
-        /**
-         * Anisotropic atomic displacement parameters are usually looped in
-         * a separate list. If this is the case, this code must match the
-         * _atom_site.label of the associated atom in the atom coordinate
-         * list and conform with the same rules described in _atom_site.label.
-         */
-        label: str,
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u_11: float,
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u: Matrix(3, 3),
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u_12: float,
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u_13: float,
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u_22: float,
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u_23: float,
-        /**
-         * These are the standard anisotropic atomic displacement
-         * components in angstroms squared which appear in the
-         * structure factor term:
-         *
-         * T = exp{-2pi^2^ sum~i~ [sum~j~ (U^ij^ h~i~ h~j~ a*~i~ a*~j~) ] }
-         *
-         * h = the Miller indices
-         * a* = the reciprocal-space cell lengths
-         *
-         * The unique elements of the real symmetric matrix are entered by row.
-         */
-        u_33: float,
-    },
-    /**
-     * The CATEGORY of data items used to describe atomic type information
-     * used in crystallographic structure studies.
-     */
-    atom_type: {
-        /**
-         * A description of the atom(s) designated by this atom type. In
-         * most cases this will be the element name and oxidation state of
-         * a single atom  species. For disordered or nonstoichiometric
-         * structures it will describe a combination of atom species.
-         */
-        description: str,
-        /**
-         * The identity of the atom specie(s) representing this atom type.
-         * Normally this code is the element symbol followed by the charge
-         * if there is one. The symbol may be composed of any character except
-         * an underline or a blank, with the proviso that digits designate an
-         * oxidation state and must be followed by a + or - character.
-         */
-        symbol: str,
-    },
-    /**
-     * The CATEGORY of data items used to describe atomic scattering
-     * information used in crystallographic structure studies.
-     */
-    atom_type_scat: {
-        /**
-         * The imaginary component of the anomalous dispersion scattering factors
-         * for this atom type and radiation by _diffrn_radiation_wavelength.value
-         */
-        dispersion_imag: float,
-        /**
-         * The real component of the anomalous dispersion scattering factors
-         * for this atom type and radiation by _diffrn_radiation_wavelength.value
-         */
-        dispersion_real: float,
-        /**
-         * Reference to source of scattering factors used for this atom type.
-         */
-        source: str,
-    },
-};
-exports.CifCore_Aliases = {
-    'cell.formula_units_z': [
-        'cell_formula_units_Z',
-    ],
-    'space_group.it_number': [
-        'space_group_IT_number',
-        'symmetry_Int_Tables_number',
-    ],
-    'space_group.name_h-m_full': [
-        'symmetry_space_group_name_H-M',
-    ],
-    'space_group_symop.operation_xyz': [
-        'symmetry_equiv_pos_as_xyz',
-    ],
-    'geom_bond.atom_site_label_1': [
-        'geom_bond_atom_site_id_1',
-    ],
-    'geom_bond.atom_site_label_2': [
-        'geom_bond_atom_site_id_2',
-    ],
-    'geom_bond.distance': [
-        'geom_bond_dist',
-    ],
-    'audit.block_doi': [
-        'audit_block_DOI',
-    ],
-    'database_code.cod': [
-        'database_code_COD',
-    ],
-    'database_code.csd': [
-        'database_code_CSD',
-    ],
-    'database_code.depnum_ccdc_archive': [
-        'database_code_depnum_CCDC_archive',
-    ],
-    'database_code.depnum_ccdc_fiz': [
-        'database_code_depnum_CCDC_fiz',
-    ],
-    'database_code.icsd': [
-        'database_code_ICSD',
-    ],
-    'database_code.mdf': [
-        'database_code_MDF',
-    ],
-    'database_code.nbs': [
-        'database_code_NBS',
-    ],
-    'atom_site.adp_type': [
-        'atom_site_ADP_type',
-        'atom_site_thermal_displace_type',
-    ],
-    'atom_site.label': [
-        'atom_site_id',
-    ],
-    'atom_site.site_symmetry_multiplicity': [
-        'atom_site_symmetry_multiplicity',
-    ],
-    'atom_site.u_iso_or_equiv': [
-        'atom_site_U_iso_or_equiv',
-    ],
-    'atom_site_aniso.label': [
-        'atom_site_anisotrop_id',
-    ],
-    'atom_site_aniso.u_11': [
-        'atom_site_aniso_U_11',
-        'atom_site_anisotrop_U_11',
-    ],
-    'atom_site_aniso.u_12': [
-        'atom_site_aniso_U_12',
-        'atom_site_anisotrop_U_12',
-    ],
-    'atom_site_aniso.u_13': [
-        'atom_site_aniso_U_13',
-        'atom_site_anisotrop_U_13',
-    ],
-    'atom_site_aniso.u_22': [
-        'atom_site_aniso_U_22',
-        'atom_site_anisotrop_U_22',
-    ],
-    'atom_site_aniso.u_23': [
-        'atom_site_aniso_U_23',
-        'atom_site_anisotrop_U_23',
-    ],
-    'atom_site_aniso.u_33': [
-        'atom_site_aniso_U_33',
-        'atom_site_anisotrop_U_33',
-    ],
-};
-;
-//# sourceMappingURL=cif-core.js.map