#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 11:28:36 +0300 (Thu, 07 Jun 2018) $
#$Revision: 1127 $
#$URL: svn://172.16.1.111/rod/cif/8/10/00/8100050.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_8100050
loop_
_publ_author_name
'Newnham, R. E.'
'de Haan, Y. M.'
_publ_section_title
;
 Refinement of the alpha Al2O3, Ti2O3, V2O3 and Cr2O3 structures Locality:
 synthetic
;
_journal_name_full               'Zeitschrift fur Kristallographie'
_journal_page_first              235
_journal_page_last               237
_journal_volume                  117
_journal_year                    1962
_chemical_compound_source        R110099
_chemical_formula_sum            'Al2 O3'
_chemical_name_mineral           Corundum
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.7589
_cell_length_b                   4.7589
_cell_length_c                   12.991
_cell_volume                     254.792
_exptl_crystal_density_diffrn    3.987
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_database_code               9008081
_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 helium-neon
_raman_measurement_device.excitation_laser_wavelength 780
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 4
_raman_measurement_device.power_on_sample 12
_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            R110099.rod
_rod_data_source.block           3500000
_rod_database.code               8100050
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 9008081 COD http://www.crystallography.net/cod/9008081.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
152.3502 0.0000000E+00
152.8323 0.5524440
153.3145 0.5273480
153.7966 0.4844630
154.2787 0.3462830
154.7608 0.1869160
155.2429 0.1543050
155.7250 0.1974790
156.2072 0.4298520
156.6893 0.5115360
157.1714 0.2456050
157.6535 0.2052270
158.1356 0.5988120
158.6177 1.102684
159.0999 1.927589
159.5820 2.191742
160.0641 2.037205
160.5462 1.956772
161.0283 2.199173
161.5104 2.353840
161.9926 1.975399
162.4747 1.048134
162.9568 9.7526997E-02
163.4389 8.6387999E-02
163.9210 0.4958610
164.4031 0.9171370
164.8853 0.5652390
165.3674 3.8601000E-02
165.8495 0.2193980
166.3316 0.1760860
166.8137 0.8220790
167.2958 1.571396
167.7780 2.393150
168.2601 2.959820
168.7422 3.248859
169.2243 3.067574
169.7064 2.907253
170.1885 3.011341
170.6707 3.020409
171.1528 2.578129
171.6349 1.797508
172.1170 1.145386
172.5991 1.137383
173.0812 1.847698
173.5634 2.261105
174.0455 2.132790
174.5276 1.834515
175.0097 1.276173
175.4918 0.5790630
175.9739 0.3653760
176.4561 0.6376610
176.9382 1.726017
177.4203 2.511303
177.9024 2.918640
178.3845 3.212425
178.8666 3.325832
179.3488 3.237377
179.8309 3.161564
180.3130 3.286686
180.7951 3.988228
181.2772 4.030518
181.7593 2.772976
182.2415 1.359329
182.7236 0.7559170
183.2057 1.148529
183.6878 1.868534
184.1699 1.865662
184.6520 0.4359280
185.1342 0.2680400
185.6163 0.2503930
186.0984 1.291832
186.5805 2.166489
187.0626 2.678085
187.5447 2.908222
188.0269 2.884277
188.5090 2.522755
188.9911 2.304497
189.4732 2.475353
189.9553 2.841217
190.4374 3.075684
190.9196 3.115189
191.4017 2.939228
191.8838 2.436729
192.3659 1.583981
192.8480 0.8249360
193.3301 0.3085060
193.8123 3.7967999E-02
194.2944 7.4332997E-02
194.7765 0.6399000
195.2586 1.258724
195.7407 1.405079
196.2228 1.070724
196.7050 0.7254070
197.1871 0.8590130
197.6692 0.5686146
198.1513 0.6352504
198.6334 0.5193180
199.1155 0.5694270
199.5977 0.9232860
200.0798 0.5133360
200.5619 0.1444700
201.0440 0.5900570
201.5261 0.8052600
202.0082 0.9416390
202.4904 1.069176
202.9725 1.080254
203.4546 0.7946400
203.9367 0.2442550
204.4188 0.2741470
204.9009 0.3160900
205.3831 0.4499090
205.8652 0.8525470
206.3473 0.5828170
206.8294 0.2878340
207.3115 0.3634990
207.7936 0.8526380
208.2758 1.500908
208.7579 1.958530
209.2400 2.168808
209.7221 2.286995
210.2042 2.301991
210.6863 2.270882
211.1685 2.244804
211.6506 2.240532
212.1327 2.266647
212.6148 2.345989
213.0969 2.576370
213.5790 2.641323
214.0612 2.408249
214.5433 2.102356
215.0254 1.938656
215.5075 1.959305
215.9896 1.981998
216.4717 1.718231
216.9539 0.9098090
217.4360 0.4480860
217.9181 0.5997960
218.4002 0.9783710
218.8823 1.193710
219.3644 1.150433
219.8466 1.042004
220.3287 1.154743
220.8108 1.542370
221.2929 1.796276
221.7750 1.659039
222.2571 1.456741
222.7393 1.737034
223.2214 2.679714
223.7035 3.642345
224.1856 3.703075
224.6677 2.932060
225.1498 2.271168
225.6320 2.028534
226.1141 2.024014
226.5962 1.920509
227.0783 1.597744
227.5604 1.378757
228.0425 1.776493
228.5247 2.627338
229.0068 3.239498
229.4889 3.131577
229.9710 2.611916
230.4531 2.374264
230.9352 2.533745
231.4174 2.895336
231.8995 3.505329
232.3816 4.222187
232.8637 4.619682
233.3458 4.307159
233.8279 3.494846
234.3101 2.890942
234.7922 2.628647
235.2743 2.399303
235.7564 1.854229
236.2385 1.202385
236.7206 0.8921130
237.2028 1.366955
237.6849 2.399967
238.1670 2.989933
238.6491 2.815922
239.1312 2.659336
239.6133 2.943527
240.0955 3.447781
240.5776 3.797379
241.0597 3.737530
241.5418 3.364750
242.0239 3.156929
242.5060 3.278225
242.9882 3.297340
243.4703 3.113876
243.9524 2.806702
244.4345 2.505817
244.9166 2.286537
245.3987 2.130341
245.8809 1.942589
246.3630 1.515400
246.8451 1.350426
247.3272 1.815628
247.8093 2.512981
248.2914 2.890057
248.7736 2.625153
249.2557 1.914795
249.7378 1.561890
250.2199 1.828136
250.7020 2.157940
251.1841 2.706505
251.6663 3.199490
252.1484 3.206211
252.6305 2.509106
253.1126 1.452297
253.5947 1.136482
254.0768 2.635792
254.5590 3.611111
255.0411 3.770725
255.5232 3.408096
256.0053 2.766949
256.4874 1.949329
256.9695 1.018490
257.4517 0.2474020
257.9338 0.5086060
258.4159 0.7575720
258.8980 0.2066270
259.3801 0.6771970
259.8622 1.439224
260.3444 1.919701
260.8265 2.219406
261.3086 2.536274
261.7907 3.132652
262.2728 3.267811
262.7549 2.445755
263.2371 1.461243
263.7192 1.160610
264.2013 1.746845
264.6834 2.620041
265.1655 2.891506
265.6476 2.293560
266.1298 1.775326
266.6119 1.178082
267.0940 0.7596660
267.5761 0.9426000
268.0582 1.781315
268.5403 2.649044
269.0225 2.753311
269.5046 1.879005
269.9867 1.190266
270.4688 0.6522870
270.9509 0.3982430
271.4330 0.5287440
271.9152 1.030651
272.3973 1.754662
272.8794 2.625839
273.3615 3.674374
273.8436 4.544552
274.3257 5.586281
274.8079 6.194294
275.2900 5.588772
275.7721 3.834476
276.2542 2.190998
276.7363 1.633324
277.2184 2.097488
277.7006 2.376968
278.1827 2.341240
278.6648 2.224289
279.1469 2.181751
279.6290 2.223579
280.1111 2.263977
280.5933 2.146790
281.0754 1.994953
281.5575 2.175175
282.0396 2.850830
282.5217 3.611431
283.0038 4.317871
283.4860 4.972687
283.9681 5.368050
284.4502 5.314121
284.9323 5.011559
285.4144 4.907764
285.8965 5.093838
286.3787 5.311604
286.8608 5.345440
287.3429 5.255642
287.8250 5.313992
288.3071 5.697239
288.7892 6.139408
289.2714 6.264080
289.7535 6.060879
290.2356 5.731407
290.7177 5.267788
291.1998 4.745045
291.6819 4.354088
292.1641 4.137936
292.6462 4.066895
293.1283 4.126839
293.6104 4.303177
294.0925 4.531559
294.5746 4.756054
295.0568 5.025078
295.5389 5.506981
296.0210 6.330833
296.5031 7.032276
296.9852 7.074680
297.4673 6.658417
297.9495 6.285652
298.4316 6.058170
298.9137 5.990215
299.3958 6.197102
299.8779 6.758942
300.3600 7.212326
300.8422 7.180561
301.3243 6.834515
301.8064 6.422203
302.2885 5.871525
302.7706 5.392918
303.2527 5.334515
303.7349 5.735928
304.2170 5.972988
304.6991 5.542313
305.1812 4.877213
305.6633 4.622875
306.1454 5.027657
306.6276 5.424801
307.1097 5.169807
307.5918 4.299053
308.0739 3.394279
308.5560 2.459629
309.0381 1.769035
309.5203 1.669182
310.0024 2.220444
310.4845 2.813122
310.9666 3.029888
311.4487 2.931320
311.9308 2.808098
312.4130 2.684143
312.8951 2.593082
313.3772 2.600304
313.8593 2.685356
314.3414 2.707237
314.8235 2.591431
315.3057 2.358391
315.7878 1.973454
316.2699 1.342934
316.7520 0.9045070
317.2341 1.186707
317.7162 1.848808
318.1984 2.153732
318.6805 1.609070
319.1626 0.6615330
319.6447 1.3580000E-02
320.1268 0.3926580
320.6089 0.6187100
321.0911 0.7867700
321.5732 0.8393940
322.0553 0.6481360
322.5374 0.8613114
323.0195 0.5638500
323.5016 1.030979
323.9838 1.325554
324.4659 1.341022
324.9480 0.7674030
325.4301 8.2782999E-02
325.9122 4.6131000E-02
326.3943 0.5304260
326.8765 1.036076
327.3586 0.7703670
327.8407 1.085029
328.3228 0.7717170
328.8049 0.9996800
329.2870 0.9352950
329.7692 0.6512870
330.2513 0.1727560
330.7334 0.2070540
331.2155 0.1280860
331.6976 0.1319200
332.1797 0.2356950
332.6619 1.592243
333.1440 2.793537
333.6261 2.506557
334.1082 1.306732
334.5903 0.5465810
335.0724 1.181255
335.5546 2.199841
336.0367 2.149773
336.5188 0.9235690
337.0009 0.2731900
337.4830 0.7173310
337.9651 0.6778370
338.4473 0.6868020
338.9294 0.9010890
339.4115 1.012497
339.8936 0.6931460
340.3757 1.072370
340.8578 0.6791610
341.3400 1.334042
341.8221 1.741035
342.3042 1.508289
342.7863 0.5022430
343.2684 0.3657110
343.7505 0.5992580
344.2327 0.3685040
344.7148 5.3431999E-02
345.1969 0.2918780
345.6790 0.6378940
346.1611 1.021439
346.6432 1.426796
347.1254 1.600800
347.6075 1.227848
348.0896 0.7090720
348.5717 0.5258330
349.0538 0.7210580
349.5359 1.164413
350.0181 1.963234
350.5002 2.946217
350.9823 3.402081
351.4644 2.820610
351.9465 2.103043
352.4286 1.837009
352.9108 1.961815
353.3929 2.204922
353.8750 2.493805
354.3571 2.760647
354.8392 2.809242
355.3214 2.484238
355.8035 2.314709
356.2856 2.586227
356.7677 3.122894
357.2498 3.525322
357.7319 3.630878
358.2141 3.860199
358.6962 4.867939
359.1783 6.760704
359.6604 8.732204
360.1425 10.66711
360.6246 12.66858
361.1068 14.97819
361.5889 17.58318
362.0710 19.94141
362.5531 21.59229
363.0352 22.52212
363.5173 23.30169
363.9995 23.90482
364.4816 24.40506
364.9637 24.51374
365.4458 24.52349
365.9279 25.21570
366.4100 27.05729
366.8922 29.70733
367.3743 32.03709
367.8564 33.54026
368.3385 35.46042
368.8206 38.21158
369.3027 41.35538
369.7849 44.23707
370.2670 46.69353
370.7491 49.32010
371.2312 52.93954
371.7133 57.75133
372.1954 63.06794
372.6776 68.34021
373.1597 74.48618
373.6418 81.47360
374.1239 89.72577
374.6060 100.3641
375.0881 114.4879
375.5703 131.9996
376.0524 151.0435
376.5345 171.9611
377.0166 194.0637
377.4987 221.8423
377.9808 249.5704
378.4630 271.1800
378.9451 283.9366
379.4272 285.4810
379.9093 269.1383
380.3914 221.5965
380.8735 177.2896
381.3557 134.1100
381.8378 96.53644
382.3199 68.29667
382.8020 49.42227
383.2841 36.93572
383.7662 28.21347
384.2484 23.73553
384.7305 19.58645
385.2126 15.30119
385.6947 11.80534
386.1768 9.644920
386.6589 8.511196
387.1411 7.758404
387.6232 7.024742
388.1053 6.362526
388.5874 5.939339
389.0695 5.937351
389.5516 5.768276
390.0338 5.151741
390.5159 4.435787
390.9980 3.950371
391.4801 3.786171
391.9622 3.797497
392.4443 3.825550
392.9265 3.871006
393.4086 3.911747
393.8907 3.676247
394.3728 3.717686
394.8549 4.504673
395.3370 5.861397
395.8192 7.153316
396.3013 7.672127
396.7834 7.794476
397.2655 8.707321
397.7476 10.32520
398.2297 13.08030
398.7119 17.78117
399.1940 23.51578
399.6761 29.22753
400.1582 34.72923
400.6403 40.01595
401.1224 45.41574
401.6046 50.90046
402.0867 54.86193
402.5688 56.30184
403.0509 56.49714
403.5330 56.79873
404.0151 57.17970
404.4973 58.22929
404.9794 60.05794
405.4615 62.76235
405.9436 66.66250
406.4257 71.83953
406.9078 77.61829
407.3900 83.27436
407.8721 89.04176
408.3542 96.04197
408.8363 104.3348
409.3184 113.8779
409.8005 124.4999
410.2827 136.2957
410.7648 149.0182
411.2469 162.0228
411.7290 176.8825
412.2111 197.4093
412.6932 222.9912
413.1754 254.1247
413.6575 291.3498
414.1396 333.9417
414.6217 381.5734
415.1038 434.0133
415.5859 492.4983
416.0681 562.0446
416.5502 646.1328
417.0323 696.4601
417.5144 723.1416
417.9965 712.3795
418.4786 640.3212
418.9608 528.7565
419.4429 413.2983
419.9250 311.4839
420.4071 225.0046
420.8892 158.8941
421.3713 122.2071
421.8535 94.77789
422.3356 78.71481
422.8177 68.80779
423.2998 62.02454
423.7819 57.44327
424.2640 55.02647
424.7462 54.95445
425.2283 57.36289
425.7104 60.08924
426.1925 62.77177
426.6746 66.23993
427.1567 71.11422
427.6389 76.83389
428.1210 82.73397
428.6031 88.64938
429.0852 93.99668
429.5673 97.94057
430.0494 100.9710
430.5316 100.8282
431.0137 95.39277
431.4958 87.51110
431.9779 78.22017
432.4600 67.81335
432.9421 57.28915
433.4243 46.73316
433.9064 36.55803
434.3885 28.60346
434.8706 23.32214
435.3527 19.35644
435.8348 16.07923
436.3170 13.45090
436.7991 11.53362
437.2812 10.61141
437.7633 10.04346
438.2454 9.201721
438.7275 8.172771
439.2097 7.436495
439.6918 7.160406
440.1739 7.121302
440.6560 7.016283
441.1381 6.825333
441.6202 6.895590
442.1024 7.571907
442.5845 8.377605
443.0666 8.653778
443.5487 8.380146
444.0308 8.179922
444.5129 8.516582
444.9951 9.413181
445.4772 10.47768
445.9593 11.38605
446.4414 12.60844
446.9235 14.69867
447.4056 17.13063
447.8878 19.30382
448.3699 20.98810
448.8520 21.84774
449.3341 21.29108
449.8162 18.78466
450.2983 16.28913
450.7805 13.72052
451.2626 11.26208
451.7447 8.833057
452.2268 6.530592
452.7089 4.691101
453.1910 3.581539
453.6732 3.064331
454.1553 2.436655
454.6374 1.408924
455.1195 0.7301600
455.6016 0.8128930
456.0837 1.053158
456.5659 0.8596130
457.0480 0.8423787
457.5301 0.5261610
458.0122 0.6323470
458.4943 0.1790870
458.9764 0.2753960
459.4586 0.8639370
459.9407 1.216497
460.4228 0.9702400
460.9049 0.4121570
461.3870 7.0114002E-02
461.8691 0.2044890
462.3513 0.5041010
462.8334 0.5914440
463.3155 0.4744950
463.7976 0.3585910
464.2797 0.2982390
464.7618 0.2683390
465.2440 0.1841770
465.7261 3.5918999E-02
466.2082 9.6621998E-02
466.6903 0.6758160
467.1724 1.395628
467.6545 1.894293
468.1367 2.125019
468.6188 1.886097
469.1009 1.946335
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