#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-05-24 15:23:18 +0300 (Thu, 24 May 2018) $
#$Revision: 700 $
#$URL: svn://172.16.1.111/rod/cif/1/00/02/1000210.rod $
#------------------------------------------------------------------------------
#
# This file is available in the Raman Open Database (ROD),
# http://solsa.crystallography.net/rod/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1000210
loop_
_publ_author_name
'Winter, J. K.'
'Ghose, S.'
_publ_section_title
;
 Thermal expansion and high-temperature crystal chemistry of the Al2SiO5
 polymorphs T = 25 deg C
;
_journal_name_full               'American Mineralogist'
_journal_page_first              573
_journal_page_last               586
_journal_volume                  64
_journal_year                    1979
_chemical_compound_source        R060197
_chemical_formula_sum            'Al2 O5 Si'
_chemical_name_mineral           Andalusite
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.7980
_cell_length_b                   7.9031
_cell_length_c                   5.5566
_cell_volume                     342.444
_diffrn_ambient_temperature      298.15
_exptl_crystal_density_diffrn    3.143
_cod_original_formula_sum        'Al2 Si O5'
_cod_database_code               9000715
_raman_determination_method      experimental
_raman_measurement_device.location 'Arizona University'
_raman_measurement_device.company 'Thermo Scientific'
_raman_measurement_device.model  'Nicolet Almega XR'
_raman_measurement_device.optics_type microscope
_raman_measurement_device.microscope_system dispersive
_raman_measurement_device.microscope_objective_magnification 50
_raman_measurement_device.microscope_numerical_aperture 0.5
_raman_measurement_device.excitation_laser_type other
_raman_measurement_device.excitation_laser_wavelength 532
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 4
_raman_measurement_device.power_on_sample 15
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 1
_raman_measurement_device.diffraction_grating 400
_raman_measurement.environment   Air
_raman_measurement.environment_details
;
 The sample was measured in air.
;
_raman_measurement.temperature   300
_raman_measurement.pressure      100
_raman_measurement.background_subtraction no
_raman_measurement.background_subtraction_details
;
 No background subtraction method was applied.
;
_raman_measurement.baseline_correction no
_raman_measurement.baseline_correction_details
;
 No baseline correction method was applied.
;
_raman_measurement.integration_time 10
_rod_data_source.file            R060197.rod
_rod_data_source.block           3500000
_rod_database.code               1000210
loop_
_raman_complementary.id
_raman_complementary.method
1 XRD
loop_
_raman_measurement_device_calibration.id
_raman_measurement_device_calibration.standard
1 neon_lamp
loop_
_rod_related_entry.id
_rod_related_entry.code
_rod_related_entry.database
_rod_related_entry.uri
_rod_related_entry.description
1 9000715 COD http://www.crystallography.net/cod/9000715.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
132.1251 0.0000000E+00
132.6072 8.9813001E-02
133.0893 0.2371370
133.5714 0.4335710
134.0535 0.1326220
134.5356 9.2991002E-02
135.0178 0.1314050
135.4999 1.2695000E-02
135.9820 0.3018380
136.4641 0.7595630
136.9462 1.382557
137.4283 2.007721
137.9105 2.648121
138.3926 3.275143
138.8747 3.846718
139.3568 4.382813
139.8389 4.810062
140.3210 5.051159
140.8032 5.050434
141.2853 5.168064
141.7674 5.427197
142.2495 5.789421
142.7316 6.145115
143.2137 6.392887
143.6959 6.263783
144.1780 5.832500
144.6601 4.705353
145.1422 4.296543
145.6243 4.947269
146.1064 6.319584
146.5886 7.147228
147.0707 7.013115
147.5528 6.814915
148.0349 7.072826
148.5170 8.494408
148.9991 9.255863
149.4813 8.956245
149.9634 7.738239
150.4455 6.913918
150.9276 6.702328
151.4097 6.717495
151.8918 6.722286
152.3740 6.675362
152.8561 6.664124
153.3382 6.645317
153.8203 6.620556
154.3024 6.787762
154.7845 7.500069
155.2667 8.240383
155.7488 8.633808
156.2309 8.436131
156.7130 8.076912
157.1951 7.512989
157.6772 6.717419
158.1594 6.243160
158.6415 6.376366
159.1236 6.805626
159.6057 7.229534
160.0878 7.570221
160.5699 7.890491
161.0521 8.214584
161.5342 8.544636
162.0163 8.873363
162.4984 9.389454
162.9805 9.857250
163.4626 9.977928
163.9448 9.187119
164.4269 8.373531
164.9090 8.018936
165.3911 8.217804
165.8732 8.584194
166.3553 9.057007
166.8375 9.557392
167.3196 9.954426
167.8017 10.22186
168.2838 10.34604
168.7659 10.24666
169.2480 9.831203
169.7302 9.525200
170.2123 9.731285
170.6944 10.26973
171.1765 10.73130
171.6586 10.85541
172.1407 10.82808
172.6229 10.88128
173.1050 11.12510
173.5871 11.22664
174.0692 10.76157
174.5513 9.884624
175.0334 9.056786
175.5156 8.524059
175.9977 8.209621
176.4798 8.095444
176.9619 8.189018
177.4440 8.434273
177.9261 8.839691
178.4083 9.361782
178.8904 9.828510
179.3725 10.12805
179.8546 10.27479
180.3367 10.25236
180.8188 9.945969
181.3010 9.852184
181.7831 9.930656
182.2652 9.994644
182.7473 10.14056
183.2294 10.93792
183.7115 12.07099
184.1937 12.84997
184.6758 13.23721
185.1579 13.44762
185.6400 13.79091
186.1221 14.25569
186.6042 14.68513
187.0864 14.80933
187.5685 14.74192
188.0506 14.99183
188.5327 15.76361
189.0148 16.83262
189.4969 17.77979
189.9791 18.65540
190.4612 19.44952
190.9433 20.02509
191.4254 20.44737
191.9075 21.38198
192.3896 23.11343
192.8718 25.37650
193.3539 27.51722
193.8360 29.56673
194.3181 31.38773
194.8002 33.20530
195.2823 35.00618
195.7645 35.38027
196.2466 33.70061
196.7287 30.41312
197.2108 27.17145
197.6929 23.93445
198.1750 20.92099
198.6572 18.27900
199.1393 16.00815
199.6214 14.25703
200.1035 13.22141
200.5856 12.75940
201.0677 12.01156
201.5499 10.88438
202.0320 9.765877
202.5141 9.051872
202.9962 8.777611
203.4783 8.645729
203.9604 8.673550
204.4426 8.815369
204.9247 8.611286
205.4068 7.951580
205.8889 7.225941
206.3710 6.822666
206.8531 6.781891
207.3353 6.860619
207.8174 7.011967
208.2995 7.236614
208.7816 7.548790
209.2637 7.952866
209.7458 8.425011
210.2280 8.936787
210.7101 9.481308
211.1922 10.08855
211.6743 10.77227
212.1564 11.52369
212.6385 12.34138
213.1207 13.26763
213.6028 14.17355
214.0849 14.94896
214.5670 15.61541
215.0491 16.07802
215.5313 16.41982
216.0134 16.63535
216.4955 16.02488
216.9776 14.32121
217.4597 12.15685
217.9418 10.13299
218.4240 8.310974
218.9061 6.500034
219.3882 4.540588
219.8703 2.441662
220.3524 0.9874880
220.8345 0.3917920
221.3167 0.1916050
221.7988 5.7766002E-02
222.2809 0.3763960
222.7630 0.6959270
223.2451 0.9987950
223.7272 1.285614
224.2094 1.579540
224.6915 1.858479
225.1736 2.171551
225.6557 2.593220
226.1378 3.255249
226.6199 3.757813
227.1021 4.048943
227.5842 4.129375
228.0663 3.876717
228.5484 2.957291
229.0305 2.060669
229.5126 1.894638
229.9948 2.902508
230.4769 3.744614
230.9590 4.219975
231.4411 4.326763
231.9232 4.120655
232.4053 3.366928
232.8875 2.545307
233.3696 2.117146
233.8517 2.387489
234.3338 2.445873
234.8159 2.089046
235.2980 1.321774
235.7802 0.6582450
236.2623 0.1398540
236.7444 0.3208240
237.2265 0.7859730
237.7086 1.225082
238.1907 1.743904
238.6729 2.468781
239.1550 3.365395
239.6371 3.828568
240.1192 3.715881
240.6013 3.332733
241.0834 2.857231
241.5656 2.060898
242.0477 1.638985
242.5298 1.763756
243.0119 2.385132
243.4940 3.008591
243.9761 3.678566
244.4583 4.296478
244.9404 4.810524
245.4225 5.296944
245.9046 5.508484
246.3867 5.299400
246.8688 4.754745
247.3510 4.467827
247.8331 4.518555
248.3152 4.724068
248.7973 4.956886
249.2794 5.138245
249.7615 5.535194
250.2437 6.253960
250.7258 7.214424
251.2079 7.994522
251.6900 8.430794
252.1721 8.919846
252.6542 9.697182
253.1364 10.81914
253.6185 12.06870
254.1006 13.36907
254.5827 14.78546
255.0648 16.53268
255.5469 18.58217
256.0291 20.97104
256.5112 23.55718
256.9933 25.79997
257.4754 29.74431
257.9575 35.85979
258.4396 43.61038
258.9218 51.28948
259.4039 58.87743
259.8860 66.55867
260.3681 74.67467
260.8502 83.83302
261.3323 92.13450
261.8145 101.0587
262.2966 108.2119
262.7787 107.8846
263.2608 97.77668
263.7429 84.96577
264.2250 71.40196
264.7072 56.17835
265.1893 44.42648
265.6714 36.72453
266.1535 32.12023
266.6356 29.14546
267.1177 28.08384
267.5999 27.83900
268.0820 28.01421
268.5641 28.58231
269.0462 29.83340
269.5283 31.89009
270.0104 34.50748
270.4926 37.28948
270.9747 40.11931
271.4568 43.64806
271.9389 48.17686
272.4210 53.77301
272.9031 59.56612
273.3853 65.64389
273.8674 71.77515
274.3495 77.70699
274.8316 83.64886
275.3137 88.45253
275.7958 91.66769
276.2780 93.37189
276.7601 94.72606
277.2422 95.54207
277.7243 96.47984
278.2064 98.00126
278.6885 100.0218
279.1707 103.3236
279.6528 108.2760
280.1349 114.6442
280.6170 121.2640
281.0991 128.1168
281.5812 135.3409
282.0634 142.8033
282.5455 150.5912
283.0276 159.2270
283.5097 168.8824
283.9918 179.3966
284.4739 190.2959
284.9561 201.5681
285.4382 213.4584
285.9203 226.8396
286.4024 241.4807
286.8845 254.7901
287.3666 266.0437
287.8488 275.8232
288.3309 286.1526
288.8130 297.1269
289.2951 305.5392
289.7772 309.6087
290.2593 309.4108
290.7415 305.2000
291.2236 296.7589
291.7057 284.8829
292.1878 270.2486
292.6699 253.0161
293.1520 234.7437
293.6342 215.8941
294.1163 196.6325
294.5984 178.0254
295.0805 159.8472
295.5626 142.7787
296.0447 127.2976
296.5269 113.3916
297.0090 100.9603
297.4911 90.16280
297.9732 80.81951
298.4553 72.97834
298.9374 66.71441
299.4196 61.31082
299.9017 55.92274
300.3838 50.84565
300.8659 46.96843
301.3480 45.21643
301.8301 44.61372
302.3123 43.76940
302.7944 42.69020
303.2765 41.74889
303.7586 41.43648
304.2407 41.44608
304.7228 41.17828
305.2050 40.12480
305.6871 39.04262
306.1692 38.64906
306.6513 38.92952
307.1334 39.84499
307.6155 41.73608
308.0977 44.13359
308.5798 46.39223
309.0619 48.18366
309.5440 50.17107
310.0261 52.80966
310.5082 56.07129
310.9904 59.85557
311.4725 63.98638
311.9546 68.72199
312.4367 74.35819
312.9188 81.01888
313.4009 88.26494
313.8831 95.55392
314.3652 103.1717
314.8473 111.7664
315.3294 122.4486
315.8115 133.6804
316.2936 144.7973
316.7758 155.8454
317.2579 165.9561
317.7400 175.6408
318.2221 183.9751
318.7042 190.0077
319.1863 194.1896
319.6685 195.3334
320.1506 192.6552
320.6327 186.1109
321.1148 177.3514
321.5969 165.6008
322.0790 152.5394
322.5612 139.3010
323.0433 124.9794
323.5254 111.8369
324.0075 100.5740
324.4896 91.01389
324.9717 82.17984
325.4539 73.62798
325.9360 65.83296
326.4181 59.15627
326.9002 54.28546
327.3823 49.61459
327.8644 44.69949
328.3466 39.86554
328.8287 36.11394
329.3108 34.03110
329.7929 32.51910
330.2750 31.26036
330.7571 30.29836
331.2393 29.45621
331.7214 28.81021
332.2035 28.25236
332.6856 27.59072
333.1677 26.53584
333.6498 25.78521
334.1320 25.54210
334.6141 25.84412
335.0962 26.40807
335.5783 27.45955
336.0604 28.54520
336.5425 29.16257
337.0247 29.04763
337.5068 29.12043
337.9889 29.56170
338.4710 30.35352
338.9531 31.24865
339.4352 32.13954
339.9174 33.36163
340.3995 35.27486
340.8816 38.01996
341.3637 40.73878
341.8458 43.44214
342.3279 46.01164
342.8101 48.05991
343.2922 49.44736
343.7743 50.84650
344.2564 52.67728
344.7385 54.95699
345.2206 57.34338
345.7028 59.81625
346.1849 62.45292
346.6670 65.41302
347.1491 68.67658
347.6312 72.03764
348.1133 75.18314
348.5955 78.39408
349.0776 82.60743
349.5597 87.87397
350.0418 93.86053
350.5239 100.5272
351.0060 107.7128
351.4882 114.6193
351.9703 120.9631
352.4524 126.9328
352.9345 132.5114
353.4166 137.7553
353.8987 143.1895
354.3809 149.6031
354.8630 156.3200
355.3451 162.2769
355.8272 167.4314
356.3093 171.4009
356.7914 174.0881
357.2736 175.3705
357.7557 174.8236
358.2378 171.7611
358.7199 167.0630
359.2020 161.4160
359.6841 154.9002
360.1663 147.4356
360.6484 138.5220
361.1305 128.7354
361.6126 118.8852
362.0947 108.8354
362.5768 99.17512
363.0590 89.94395
363.5411 81.15916
364.0232 73.26210
364.5053 66.66821
364.9874 60.87499
365.4695 55.49146
365.9517 50.30286
366.4338 45.66513
366.9159 41.67964
367.3980 38.28599
367.8801 35.23304
368.3622 32.53632
368.8444 30.16990
369.3265 28.17387
369.8086 26.91376
370.2907 25.34090
370.7728 23.18133
371.2549 20.79650
371.7371 18.78944
372.2192 17.29811
372.7013 15.99052
373.1834 14.81156
373.6655 13.76012
374.1476 12.81068
374.6298 12.10284
375.1119 11.35849
375.5940 10.22321
376.0761 8.468277
376.5582 7.099899
377.0403 6.316780
377.5225 6.047424
378.0046 6.051865
378.4867 6.447891
378.9688 6.692680
379.4509 6.301804
379.9330 5.263313
380.4152 4.481873
380.8973 4.034248
381.3794 3.865250
381.8615 4.067795
382.3436 4.626053
382.8257 4.909813
383.3079 4.339195
383.7900 3.252174
384.2721 2.898209
384.7542 3.336655
385.2363 3.887489
385.7184 3.793991
386.2006 3.270775
386.6827 2.903748
387.1648 2.926720
387.6469 3.142090
388.1290 3.318916
388.6111 3.467896
389.0933 3.647278
389.5754 4.042274
390.0575 4.429390
390.5396 4.567131
391.0217 4.427078
391.5038 3.994705
391.9860 3.071014
392.4681 1.867935
392.9502 0.7551270
393.4323 0.1383510
393.9144 0.8624570
394.3965 1.396080
394.8787 1.737190
395.3608 2.055176
395.8429 2.450043
396.3250 2.835884
396.8071 3.138054
397.2892 3.224403
397.7714 3.352455
398.2535 3.581749
398.7356 3.900040
399.2177 4.240906
399.6998 4.913338
400.1819 5.347031
400.6641 5.257355
401.1462 4.285454
401.6283 3.529099
402.1104 3.075150
402.5925 2.797256
403.0746 2.508156
403.5568 2.233688
404.0389 1.896362
404.5210 1.428947
405.0031 0.8311920
405.4852 0.4573970
405.9673 0.4013370
406.4495 0.3917850
406.9316 0.1893010
407.4137 0.2291720
407.8958 0.6737140
408.3779 1.137497
408.8600 1.594879
409.3422 1.971550
409.8243 2.262520
410.3064 2.535767
410.7885 2.817719
411.2706 3.113174
411.7527 3.399872
412.2349 3.655052
412.7170 4.034615
413.1991 4.903458
413.6812 6.086273
414.1633 6.965752
414.6454 7.102562
415.1276 6.979340
415.6097 7.178116
416.0918 7.684135
416.5739 8.400146
417.0560 9.605682
417.5381 10.84445
418.0203 11.54470
418.5024 11.46405
418.9845 11.17109
419.4666 11.09044
419.9487 11.04547
420.4308 10.70772
420.9130 9.398422
421.3951 8.224747
421.8772 7.911461
422.3593 8.590248
422.8414 8.922859
423.3235 8.237640
423.8057 7.227966
424.2878 6.456116
424.7699 6.289200
425.2520 6.030800
425.7341 5.425255
426.2162 4.639084
426.6984 4.271439
427.1805 4.752846
427.6626 5.159348
428.1447 5.050140
428.6268 4.136902
429.1089 3.811546
429.5911 4.343842
430.0732 5.176430
430.5553 5.572723
431.0374 5.385101
431.5195 5.330025
432.0016 5.530708
432.4838 5.996422
432.9659 6.957741
433.4480 8.537575
433.9301 9.840271
434.4122 9.939705
434.8943 9.045509
435.3765 8.718727
435.8586 9.198105
436.3407 10.01138
436.8228 10.48439
437.3049 10.71566
437.7870 11.10165
438.2692 11.99098
438.7513 13.07991
439.2334 13.94968
439.7155 14.60143
440.1976 15.15268
440.6797 15.54049
441.1619 15.95013
441.6440 16.63462
442.1261 17.76505
442.6082 18.96178
443.0903 19.98819
443.5724 20.91172
444.0546 21.89185
444.5367 22.72064
445.0188 23.81741
445.5009 25.55937
445.9830 28.07318
446.4651 30.32693
446.9473 31.78023
447.4294 33.07995
447.9115 34.75079
448.3936 37.15586
448.8757 39.54719
449.3578 42.01500
449.8400 44.42274
450.3221 46.57970
450.8042 49.14867
451.2863 50.40030
451.7684 49.50484
452.2505 46.22665
452.7327 42.15966
453.2148 37.03147
453.6969 31.65281
454.1790 27.05102
454.6611 23.19179
455.1432 19.98164
455.6254 17.46413
456.1075 15.54157
456.5896 14.15670
457.0717 13.28820
457.5538 12.54239
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