sigima 0.0.1.dev0__py3-none-any.whl → 1.0.0__py3-none-any.whl

sigima/data/tests/curve_formats/paracetamol.txt

@@ -0,0 +1,1010 @@
+##NAMES=Paracetamol
+##RRUFFID=D120007
+##IDEAL CHEMISTRY=C_8_H_9_NO_2_
+##LOCALITY=Synthetic from Sigma
+##OWNER=RRUFF
+##SOURCE=David Blake
+##DESCRIPTION=Fine colorless powder. Paracetamol, otherwise known as acetaminophen, is an analgesic and antipyretic.
+##STATUS=The identification of this mineral is not yet confirmed.
+##URL=rruff.info/D120007
+2 theta (°), Intensity
+5, 144.95
+5.05, 130.958
+5.1, 138.617
+5.15, 127.86
+5.2, 130.526
+5.25, 129.117
+5.3, 146.902
+5.35, 126.054
+5.4, 130.71
+5.45, 136.944
+5.5, 132.646
+5.55, 135.503
+5.6, 131.31
+5.65, 134.392
+5.7, 134.115
+5.75, 142.336
+5.8, 124.004
+5.85, 137.182
+5.9, 144.611
+5.95, 125.155
+6, 133.639
+6.05, 137.911
+6.1, 130.834
+6.15, 127.603
+6.2, 130.111
+6.25, 128.666
+6.3, 131.237
+6.35, 123.651
+6.4, 133.444
+6.45, 129.991
+6.5, 124.31
+6.55, 125.31
+6.6, 127.22
+6.65, 126.525
+6.7, 118.994
+6.75, 127.921
+6.8, 124.564
+6.85, 133.317
+6.9, 127.625
+6.95, 127.094
+7, 125.326
+7.05, 126.764
+7.1, 126.101
+7.15, 118.474
+7.2, 127.064
+7.25, 131.091
+7.3, 135.68
+7.35, 128.569
+7.4, 129.097
+7.45, 126.45
+7.5, 128.518
+7.55, 129.235
+7.6, 123.793
+7.65, 126.139
+7.7, 132.394
+7.75, 127.318
+7.8, 126.314
+7.85, 126.112
+7.9, 132.29
+7.95, 136.732
+8, 135.149
+8.05, 139.587
+8.1, 134.642
+8.15, 139.803
+8.2, 141.572
+8.25, 153.708
+8.3, 148.54
+8.35, 151.054
+8.4, 153.85
+8.45, 157.294
+8.5, 158.885
+8.55, 162.167
+8.6, 165.507
+8.65, 156.191
+8.7, 145.237
+8.75, 151.594
+8.8, 147.153
+8.85, 141.447
+8.9, 143.715
+8.95, 127.63
+9, 130.104
+9.05, 130.851
+9.1, 118.595
+9.15, 130.604
+9.2, 131.175
+9.25, 118.46
+9.3, 126.75
+9.35, 126.365
+9.4, 132.485
+9.45, 126.401
+9.5, 122.79
+9.55, 126.146
+9.6, 133.005
+9.65, 126.313
+9.7, 124.658
+9.75, 128.092
+9.8, 129.795
+9.85, 124.484
+9.9, 126.61
+9.95, 131.695
+10, 127.967
+10.05, 126.272
+10.1, 134.518
+10.15, 119.874
+10.2, 124.126
+10.25, 132.356
+10.3, 130.05
+10.35, 121.237
+10.4, 120.844
+10.45, 123.974
+10.5, 122.742
+10.55, 124.796
+10.6, 135.243
+10.65, 126.549
+10.7, 117.422
+10.75, 135.101
+10.8, 134.725
+10.85, 124.339
+10.9, 121.157
+10.95, 124.966
+11, 119.67
+11.05, 124.525
+11.1, 118.806
+11.15, 124.037
+11.2, 116.881
+11.25, 122.862
+11.3, 120.684
+11.35, 126.824
+11.4, 137.45
+11.45, 131.534
+11.5, 123.983
+11.55, 132.546
+11.6, 134.337
+11.65, 130.428
+11.7, 137.611
+11.75, 133.468
+11.8, 129.303
+11.85, 121.403
+11.9, 134.409
+11.95, 126.763
+12, 130.066
+12.05, 125.678
+12.1, 120.724
+12.15, 133.341
+12.2, 118.668
+12.25, 129.796
+12.3, 120.248
+12.35, 118.123
+12.4, 131.801
+12.45, 125.781
+12.5, 118.983
+12.55, 125.76
+12.6, 118.283
+12.65, 122.163
+12.7, 114.645
+12.75, 117.965
+12.8, 132.209
+12.85, 133.292
+12.9, 130.209
+12.95, 139.162
+13, 128.423
+13.05, 118.367
+13.1, 125.668
+13.15, 133.322
+13.2, 114.769
+13.25, 129.273
+13.3, 129.894
+13.35, 137.251
+13.4, 150.487
+13.45, 151.853
+13.5, 174.944
+13.55, 201.962
+13.6, 237.979
+13.65, 284.611
+13.7, 358.771
+13.75, 385.925
+13.8, 415.682
+13.85, 426.614
+13.9, 463.492
+13.95, 475.314
+14, 438.313
+14.05, 430.992
+14.1, 399.599
+14.15, 358.187
+14.2, 337.351
+14.25, 269.738
+14.3, 215.848
+14.35, 174.793
+14.4, 162.602
+14.45, 138.565
+14.5, 151.972
+14.55, 120.998
+14.6, 129.249
+14.65, 128.467
+14.7, 120.479
+14.75, 123.251
+14.8, 129.125
+14.85, 130.553
+14.9, 126.714
+14.95, 132.646
+15, 128.372
+15.05, 123.694
+15.1, 125.085
+15.15, 118.172
+15.2, 130.737
+15.25, 129.561
+15.3, 121.835
+15.35, 142.207
+15.4, 119.999
+15.45, 129.761
+15.5, 121.199
+15.55, 138.558
+15.6, 133.687
+15.65, 143.158
+15.7, 168.679
+15.75, 210.864
+15.8, 240.63
+15.85, 316.948
+15.9, 401.51
+15.95, 510.351
+16, 575.553
+16.05, 599.754
+16.1, 629.712
+16.15, 585.877
+16.2, 522.757
+16.25, 433.674
+16.3, 333.33
+16.35, 248.149
+16.4, 193.047
+16.45, 171.919
+16.5, 145.249
+16.55, 149.683
+16.6, 130.978
+16.65, 154.966
+16.7, 151.103
+16.75, 147.778
+16.8, 139.722
+16.85, 149.863
+16.9, 154.948
+16.95, 153.706
+17, 152.32
+17.05, 164.354
+17.1, 162.43
+17.15, 144.656
+17.2, 153.821
+17.25, 155.359
+17.3, 139.634
+17.35, 150.208
+17.4, 149.206
+17.45, 158.561
+17.5, 179.514
+17.55, 189.998
+17.6, 225.865
+17.65, 258.699
+17.7, 301.535
+17.75, 346.1
+17.8, 436.152
+17.85, 563.963
+17.9, 693.097
+17.95, 795.983
+18, 922.02
+18.05, 986.19
+18.1, 997.449
+18.15, 913.216
+18.2, 857.842
+18.25, 704.079
+18.3, 552.753
+18.35, 450.754
+18.4, 359.362
+18.45, 308.906
+18.5, 271.303
+18.55, 259.971
+18.6, 247.38
+18.65, 235.205
+18.7, 233.156
+18.75, 240.439
+18.8, 219.655
+18.85, 238.381
+18.9, 242.358
+18.95, 224.804
+19, 217.139
+19.05, 214.682
+19.1, 234.321
+19.15, 232.843
+19.2, 239.377
+19.25, 271.223
+19.3, 296.601
+19.35, 349.65
+19.4, 414.915
+19.45, 453.014
+19.5, 475.948
+19.55, 465.006
+19.6, 436.328
+19.65, 377.371
+19.7, 302.985
+19.75, 259.159
+19.8, 214.726
+19.85, 199.541
+19.9, 191.483
+19.95, 174.363
+20, 183.943
+20.05, 172.731
+20.1, 180.382
+20.15, 167.302
+20.2, 186.818
+20.25, 166.506
+20.3, 176.664
+20.35, 166.334
+20.4, 161.125
+20.45, 171.349
+20.5, 173.675
+20.55, 162.959
+20.6, 180.984
+20.65, 187.443
+20.7, 199.199
+20.75, 207.095
+20.8, 225.995
+20.85, 246.59
+20.9, 285.148
+20.95, 340.1
+21, 446.62
+21.05, 582.385
+21.1, 654.08
+21.15, 729.274
+21.2, 760.561
+21.25, 725.147
+21.3, 657.166
+21.35, 562.369
+21.4, 411.676
+21.45, 317.024
+21.5, 244.341
+21.55, 195.207
+21.6, 173.296
+21.65, 155.771
+21.7, 144.105
+21.75, 139.791
+21.8, 139.447
+21.85, 148.986
+21.9, 151.228
+21.95, 155.93
+22, 163.39
+22.05, 160.719
+22.1, 155.959
+22.15, 154.821
+22.2, 149.745
+22.25, 149.557
+22.3, 134.243
+22.35, 133.744
+22.4, 132.446
+22.45, 125.265
+22.5, 131.207
+22.55, 133.317
+22.6, 129.588
+22.65, 131.296
+22.7, 121.493
+22.75, 121.23
+22.8, 130.54
+22.85, 123.753
+22.9, 118.983
+22.95, 122.956
+23, 113.356
+23.05, 116.166
+23.1, 127.571
+23.15, 125.147
+23.2, 137.035
+23.25, 155.434
+23.3, 170.429
+23.35, 180.516
+23.4, 196.616
+23.45, 211.396
+23.5, 216.658
+23.55, 237.929
+23.6, 276.499
+23.65, 291.107
+23.7, 328.354
+23.75, 333.171
+23.8, 343.157
+23.85, 330.592
+23.9, 287.284
+23.95, 262.081
+24, 224.983
+24.05, 232.686
+24.1, 221.321
+24.15, 239.779
+24.2, 283.117
+24.25, 272.335
+24.3, 273.056
+24.35, 252.636
+24.4, 220.542
+24.45, 172.207
+24.5, 150.821
+24.55, 133.023
+24.6, 131.079
+24.65, 125.341
+24.7, 122.106
+24.75, 122.052
+24.8, 127.441
+24.85, 115.91
+24.9, 120.508
+24.95, 124.163
+25, 108.357
+25.05, 114.624
+25.1, 120.72
+25.15, 122.091
+25.2, 119.482
+25.25, 129.144
+25.3, 123.056
+25.35, 126.572
+25.4, 123.624
+25.45, 115.467
+25.5, 120.053
+25.55, 118.137
+25.6, 128.948
+25.65, 130.204
+25.7, 126.32
+25.75, 128.999
+25.8, 132.911
+25.85, 130.626
+25.9, 133.537
+25.95, 133.16
+26, 135.097
+26.05, 123.364
+26.1, 129.515
+26.15, 121.09
+26.2, 120.242
+26.25, 123.316
+26.3, 116.317
+26.35, 114.714
+26.4, 118.821
+26.45, 111.891
+26.5, 130.199
+26.55, 121.559
+26.6, 128.008
+26.65, 134.657
+26.7, 137.686
+26.75, 154.145
+26.8, 172.061
+26.85, 208.748
+26.9, 216.904
+26.95, 233.256
+27, 238.691
+27.05, 231.06
+27.1, 228.972
+27.15, 246.491
+27.2, 307.083
+27.25, 367.255
+27.3, 494.578
+27.35, 583.502
+27.4, 662.527
+27.45, 683.387
+27.5, 628.664
+27.55, 527.825
+27.6, 412.596
+27.65, 289.458
+27.7, 222.51
+27.75, 165.663
+27.8, 146.087
+27.85, 143.243
+27.9, 147.558
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+28, 135.915
+28.05, 138.778
+28.1, 153.454
+28.15, 182.119
+28.2, 231.315
+28.25, 331.988
+28.3, 485.443
+28.35, 655.047
+28.4, 747.839
+28.45, 794.338
+28.5, 768.941
+28.55, 730.637
+28.6, 606.509
+28.65, 497.263
+28.7, 365.608
+28.75, 301.191
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+28.85, 236.869
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+29, 217.086
+29.05, 200.749
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+29.7, 105.712
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+30, 104.262
+30.05, 108.8
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+30.5, 108.779
+30.55, 122.623
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+30.65, 175.396
+30.7, 153.839
+30.75, 177.213
+30.8, 264.975
+30.85, 403.475
+30.9, 603.393
+30.95, 739.19
+31, 868.527
+31.05, 895.174
+31.1, 871.207
+31.15, 767.671
+31.2, 580.394
+31.25, 411.294
+31.3, 254.655
+31.35, 174.042
+31.4, 141.004
+31.45, 132.848
+31.5, 143.299
+31.55, 173.763
+31.6, 222.379
+31.65, 273.548
+31.7, 336.13
+31.75, 342.951
+31.8, 368.917
+31.85, 344.129
+31.9, 301.892
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+32, 210.377
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+41.75, 63.4685
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+41.85, 69.7443
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+42.7, 159.794
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