#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 11:28:16 +0300 (Thu, 07 Jun 2018) $
#$Revision: 1121 $
#$URL: svn://172.16.1.111/rod/cif/8/10/00/8100048.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_8100048
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        R100131
_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            R100131.rod
_rod_data_source.block           3500000
_rod_database.code               8100048
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
166.2977 0.0000000E+00
166.7798 0.7848050
167.2620 2.888382
167.7441 4.204361
168.2262 3.724968
168.7083 2.114098
169.1904 1.301727
169.6725 1.457626
170.1547 1.836708
170.6368 2.412262
171.1189 3.041183
171.6010 3.147606
172.0831 2.133392
172.5652 0.7102050
173.0474 0.3431240
173.5295 1.513405
174.0116 2.823433
174.4937 2.988541
174.9758 2.010475
175.4579 1.405029
175.9401 2.352386
176.4222 3.767769
176.9043 4.440338
177.3864 3.980598
177.8685 3.093651
178.3506 2.686638
178.8328 2.743294
179.3149 2.916748
179.7970 3.350403
180.2791 3.708534
180.7612 3.635834
181.2433 3.143768
181.7255 2.118752
182.2076 1.198151
182.6897 0.5612110
183.1718 8.5143998E-02
183.6539 0.4653780
184.1360 1.275177
184.6181 2.206505
185.1003 3.144241
185.5824 3.906876
186.0645 3.800972
186.5466 1.483490
187.0287 7.4600004E-02
187.5108 6.6803001E-02
187.9930 1.030571
188.4751 1.637749
188.9572 1.199051
189.4393 1.2444000E-02
189.9214 0.4541470
190.4035 0.8367540
190.8857 1.828003
191.3678 1.930244
191.8499 1.492058
192.3320 1.166000
192.8141 1.367767
193.2962 1.995239
193.7784 2.242538
194.2605 2.070824
194.7426 1.674026
195.2247 0.6281890
195.7068 0.6841890
196.1889 1.018692
196.6711 0.7905040
197.1532 4.020447
197.6353 5.079079
198.1174 1.848373
198.5995 1.379631
199.0816 1.934151
199.5638 0.1597290
200.0459 1.566376
200.5280 1.713951
201.0101 0.8410490
201.4922 0.7287750
201.9743 2.093094
202.4565 3.571609
202.9386 3.828850
203.4207 2.828438
203.9028 1.956779
204.3849 2.197945
204.8670 2.954964
205.3492 3.349922
205.8313 3.054947
206.3134 2.567467
206.7955 2.558456
207.2776 3.144470
207.7597 3.664528
208.2419 3.947464
208.7240 3.960548
209.2061 3.506073
209.6882 2.343033
210.1703 1.052299
210.6524 0.7457890
211.1346 1.851730
211.6167 2.851166
212.0988 3.180458
212.5809 3.217972
213.0630 3.357300
213.5451 3.783112
214.0273 4.268959
214.5094 4.250671
214.9915 3.354012
215.4736 2.617004
215.9557 1.938042
216.4378 1.609344
216.9200 2.105354
217.4021 3.668190
217.8842 5.770309
218.3663 6.862755
218.8484 5.877640
219.3305 5.385635
219.8127 6.179710
220.2948 7.381912
220.7769 8.025963
221.2590 7.669968
221.7411 6.640709
222.2232 5.901642
222.7054 5.686745
223.1875 5.517441
223.6696 5.254486
224.1517 5.030083
224.6338 5.200256
225.1159 5.912170
225.5980 6.835228
226.0802 6.999619
226.5623 5.113594
227.0444 4.001160
227.5265 4.500145
228.0086 5.701096
228.4907 6.402893
228.9729 6.081337
229.4550 5.164383
229.9371 4.760780
230.4192 5.050621
230.9013 5.515961
231.3834 6.474808
231.8656 7.486526
232.3477 7.762703
232.8298 6.824837
233.3119 5.337708
233.7940 4.839096
234.2761 5.647430
234.7583 6.444344
235.2404 6.769463
235.7225 6.841133
236.2046 7.089729
236.6867 7.675514
237.1688 8.471764
237.6510 9.310432
238.1331 10.21204
238.6152 11.05637
239.0973 12.06036
239.5794 12.95778
240.0615 13.01446
240.5437 11.74417
241.0258 10.18353
241.5079 9.823593
241.9900 10.63414
242.4721 11.40342
242.9542 11.36378
243.4364 10.89616
243.9185 11.08399
244.4006 12.42426
244.8827 13.92611
245.3648 14.67385
245.8469 14.74429
246.3290 14.41541
246.8112 13.63831
247.2933 12.53384
247.7754 11.35323
248.2575 9.913864
248.7396 8.858681
249.2217 8.802391
249.7039 9.534508
250.1860 10.35792
250.6681 11.14495
251.1502 11.76908
251.6323 11.58952
252.1144 10.01797
252.5966 8.565323
253.0787 8.237938
253.5608 8.728455
254.0429 9.237221
254.5250 9.354790
255.0071 9.170776
255.4893 8.734138
255.9714 7.737640
256.4535 6.977028
256.9356 6.890907
257.4177 7.329887
257.8998 7.888458
258.3820 8.509048
258.8641 9.051895
259.3462 8.927025
259.8283 7.611015
260.3104 6.475945
260.7925 5.770668
261.2747 5.533577
261.7568 5.926521
262.2389 7.144096
262.7210 8.773308
263.2031 9.647339
263.6852 9.625206
264.1674 8.934280
264.6495 7.098000
265.1316 4.977615
265.6137 3.459412
266.0958 2.928520
266.5779 3.148285
267.0601 3.640953
267.5422 4.715485
268.0243 5.504868
268.5064 5.797073
268.9885 5.881012
269.4706 6.001854
269.9528 6.228889
270.4349 6.435898
270.9170 6.335899
271.3991 5.491577
271.8812 5.090675
272.3633 5.813652
272.8455 6.642517
273.3276 6.707832
273.8097 5.936699
274.2918 4.840324
274.7739 4.099449
275.2560 3.909660
275.7382 3.756638
276.2202 3.740730
276.7024 3.721596
277.1845 3.534454
277.6666 3.205070
278.1487 2.958786
278.6308 3.142387
279.1129 4.090828
279.5951 4.377060
280.0772 3.313011
280.5593 2.390533
281.0414 2.350449
281.5235 3.156975
282.0056 4.407249
282.4878 5.962868
282.9699 8.229301
283.4520 8.683609
283.9341 5.282288
284.4162 2.317528
284.8983 1.977051
285.3805 3.631523
285.8626 5.224747
286.3447 5.108711
286.8268 3.325623
287.3089 2.416206
287.7910 3.559677
288.2732 4.245125
288.7553 3.189484
289.2374 1.180870
289.7195 0.1311950
290.2016 0.3879390
290.6837 2.293182
291.1659 3.103928
291.6480 1.542557
292.1301 0.3859790
292.6122 0.2453310
293.0943 0.7651900
293.5764 1.553825
294.0586 2.453804
294.5407 3.274971
295.0228 3.501434
295.5049 2.317238
295.9870 1.516129
296.4691 1.274170
296.9513 1.396645
297.4334 1.787384
297.9155 2.396561
298.3976 3.009171
298.8797 3.240509
299.3618 2.685226
299.8440 2.516411
300.3261 3.141029
300.8082 3.890160
301.2903 4.270752
301.7724 4.173477
302.2545 3.705429
302.7367 2.905235
303.2188 1.537811
303.7009 0.8690720
304.1830 1.355194
304.6651 2.092117
305.1472 2.652672
305.6294 2.954292
306.1115 2.930794
306.5936 2.417694
307.0757 1.353561
307.5578 1.213089
308.0399 3.098785
308.5221 4.649940
309.0042 4.672424
309.4863 3.493675
309.9684 1.968231
310.4505 0.5279460
310.9326 0.7068060
311.4148 0.7698140
311.8969 1.784607
312.3790 3.657555
312.8611 3.439606
313.3432 2.137524
313.8253 1.505447
314.3075 2.387039
314.7896 4.080002
315.2717 4.769623
315.7538 3.490620
316.2359 2.599449
316.7180 2.673042
317.2001 3.050625
317.6823 2.943726
318.1644 2.134045
318.6465 1.080578
319.1286 0.4720190
319.6107 0.5602910
320.0928 0.5380940
320.5750 7.2944999E-02
321.0571 0.2744600
321.5392 0.1157910
322.0213 1.212215
322.5034 2.306175
322.9855 2.669395
323.4677 2.182903
323.9498 1.751102
324.4319 1.466198
324.9140 1.141056
325.3961 0.5700260
325.8782 0.1439970
326.3604 0.6835250
326.8425 0.8037610
327.3246 0.5484430
327.8067 0.4163550
328.2888 0.8259120
328.7709 0.8717580
329.2531 0.2839970
329.7352 1.851028
330.2173 2.372242
330.6994 1.103401
331.1815 1.165577
331.6636 2.303364
332.1458 1.164902
332.6279 0.2464070
333.1100 0.3856470
333.5921 0.7600980
334.0742 0.8001980
334.5563 0.5139200
335.0385 0.1740420
335.5206 0.2224430
336.0027 1.034264
336.4848 1.224663
336.9669 0.3601760
337.4490 0.7119330
337.9312 1.776794
338.4133 2.623245
338.8954 2.676811
339.3775 1.236694
339.8596 1.920738
340.3417 3.783195
340.8239 3.485855
341.3060 2.984169
341.7881 2.963135
342.2702 3.263863
342.7523 3.344940
343.2344 2.819160
343.7166 1.959404
344.1987 2.123566
344.6808 5.366730
345.1629 7.283791
345.6450 6.863060
346.1271 5.158714
346.6093 3.066345
347.0914 0.9749980
347.5735 0.8404080
348.0556 1.658787
348.5377 1.002953
349.0198 0.1567380
349.5020 1.111809
349.9841 2.333595
350.4662 3.224762
350.9483 3.770775
351.4304 4.095200
351.9125 4.298492
352.3947 4.354042
352.8768 4.445824
353.3589 4.781509
353.8410 4.938423
354.3231 4.454880
354.8052 3.685387
355.2874 3.385521
355.7695 4.129326
356.2516 5.697464
356.7337 6.880188
357.2158 7.728035
357.6979 8.038895
358.1800 6.956490
358.6621 5.707558
359.1443 5.889183
359.6264 8.105705
360.1085 11.09582
360.5906 12.49296
361.0727 11.55396
361.5548 10.91778
362.0370 11.03402
362.5191 11.40678
363.0012 11.71781
363.4833 11.95258
363.9654 12.31683
364.4475 13.11928
364.9297 14.39796
365.4118 15.35104
365.8939 15.58144
366.3760 15.93546
366.8581 16.77366
367.3402 17.98162
367.8224 19.31401
368.3045 20.65735
368.7866 21.91808
369.2687 22.90610
369.7508 23.34431
370.2329 24.38625
370.7151 26.86262
371.1972 29.88526
371.6793 32.42993
372.1614 34.08498
372.6435 36.08223
373.1256 39.76713
373.6078 45.14298
374.0899 51.95413
374.5720 60.03334
375.0541 69.88290
375.5362 82.10002
376.0183 96.56572
376.5005 111.7945
376.9826 128.0049
377.4647 144.4268
377.9468 159.1642
378.4289 174.0374
378.9110 182.6436
379.3932 179.6498
379.8753 167.8380
380.3574 150.8988
380.8395 126.7104
381.3216 100.8637
381.8037 79.94650
382.2859 63.94875
382.7680 50.99972
383.2501 40.73059
383.7322 33.06113
384.2143 27.44955
384.6964 24.28580
385.1786 22.02108
385.6607 20.14387
386.1428 18.47950
386.6249 16.56541
387.1070 14.24055
387.5891 12.04379
388.0713 10.68400
388.5534 10.07126
389.0355 9.611053
389.5176 9.341599
389.9997 9.300522
390.4818 9.444931
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393.3745 9.606407
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396.2672 10.77307
396.7494 10.81003
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398.1957 12.35513
398.6778 14.10600
399.1599 14.84356
399.6420 14.57996
400.1241 14.30306
400.6063 14.93202
401.0884 16.50622
401.5705 17.95267
402.0526 19.75158
402.5347 20.92782
403.0168 20.34630
403.4990 19.11405
403.9811 19.11599
404.4632 21.26958
404.9453 24.74199
405.4274 27.43439
405.9095 28.87093
406.3917 30.30386
406.8738 31.02683
407.3559 32.30164
407.8380 35.06662
408.3201 39.39644
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409.2844 50.32333
409.7665 56.23808
410.2486 63.38795
410.7307 70.32690
411.2128 80.35311
411.6949 94.20700
412.1771 111.7925
412.6592 132.6222
413.1413 156.2516
413.6234 183.6825
414.1055 217.6112
414.5876 259.7795
415.0698 303.7280
415.5519 354.0409
416.0340 401.3229
416.5161 443.6378
416.9982 479.4896
417.4803 496.6245
417.9625 481.5591
418.4446 437.3045
418.9267 381.4471
419.4088 307.7065
419.8909 236.3593
420.3730 178.9469
420.8552 133.3992
421.3373 97.55339
421.8194 71.94700
422.3015 54.36272
422.7836 44.09369
423.2657 41.08570
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424.2300 35.44785
424.7121 31.64598
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428.0869 40.66077
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430.0154 45.48306
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433.3902 24.92103
433.8723 20.37672
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438.6935 3.332825
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441.5862 2.231750
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443.5146 1.7775999E-02
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453.6391 4.227966
454.1212 2.922020
454.6033 1.818687
455.0854 1.185410
455.5675 0.7171710
456.0497 2.3819000E-02
456.5318 0.7713470
457.0139 1.056694
457.4960 0.4695590
457.9781 0.7116010
458.4602 1.874786
458.9424 3.425568
459.4245 4.259499
459.9066 3.799446
460.3887 2.742485
460.8708 1.682022
461.3529 0.7156830
461.8351 0.1166230
462.3172 0.8910900
462.7993 1.475342
463.2814 0.8641820
463.7635 2.381935
464.2456 4.660873
464.7278 4.534592
465.2099 3.101692
465.6920 1.710205
466.1741 0.9085080
466.6562 0.7852710
467.1383 1.688545
467.6205 4.201996
468.1026 5.941200
468.5847 6.418510
469.0668 6.464256
469.5489 6.307320
470.0310 6.008636
470.5132 5.588432
470.9953 4.958611
471.4774 4.311996
471.9595 4.268265
472.4416 5.063774
472.9237 5.577309
473.4059 5.037308
473.8880 4.259346
474.3701 4.124451
474.8522 4.760223
475.3343 5.141365
475.8164 4.186852
476.2986 2.525131
476.7807 1.781563
477.2628 2.245171
477.7449 3.058319
478.2270 3.737892
478.7091 4.246254
479.1913 4.477608
479.6734 4.032234
480.1555 3.745949
480.6376 4.449211
481.1197 5.581306
481.6018 5.763374
482.0839 4.489227
482.5660 2.879799
483.0482 2.567589
483.5303 4.107109
484.0124 4.962555
484.4945 4.654465
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