#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:41:43 +0300 (Thu, 07 Jun 2018) $
#$Revision: 929 $
#$URL: svn://172.16.1.111/rod/cif/8/10/00/8100026.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_8100026
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        R060020
_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 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            R060020.rod
_rod_data_source.block           3500000
_rod_database.code               8100026
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
130.0471 0.0000000E+00
130.5292 0.2977910
131.0113 1.041077
131.4935 2.068268
131.9756 2.465546
132.4577 1.538269
132.9398 0.1203920
133.4219 0.4390870
133.9040 2.316956
134.3862 4.251556
134.8683 4.216949
135.3504 2.374725
135.8325 0.9116210
136.3146 1.511414
136.7967 2.594238
137.2789 2.763916
137.7610 2.530457
138.2431 2.286652
138.7252 2.664612
139.2073 3.858856
139.6894 4.734131
140.1716 4.869598
140.6537 4.194336
141.1358 3.219971
141.6179 1.678162
142.1000 6.4788997E-02
142.5821 0.6507570
143.0643 0.2906800
143.5464 0.5649410
144.0285 1.865723
144.5106 4.096344
144.9927 5.393250
145.4748 5.346466
145.9570 4.435211
146.4391 4.077423
146.9212 4.692322
147.4033 5.521271
147.8854 5.870209
148.3675 5.288055
148.8497 5.059723
149.3318 5.665222
149.8139 6.528595
150.2960 6.926392
150.7781 6.636475
151.2602 6.079376
151.7424 5.625916
152.2245 4.685364
152.7066 3.973999
153.1887 3.910675
153.6708 4.448486
154.1529 4.711273
154.6351 4.218018
155.1172 3.634094
155.5993 3.436646
156.0814 4.265564
156.5635 4.803375
157.0456 4.883789
157.5278 4.117096
158.0099 3.465149
158.4920 3.584991
158.9741 3.940613
159.4562 4.119080
159.9383 3.970001
160.4205 3.754822
160.9026 3.570862
161.3847 3.576965
161.8668 3.446930
162.3489 3.017517
162.8310 2.478729
163.3132 1.870667
163.7953 0.9295040
164.2774 0.1922910
164.7595 5.7404000E-02
165.2416 0.2356260
165.7237 0.7351990
166.2059 1.708618
166.6880 2.721985
167.1701 3.116730
167.6522 1.587158
168.1343 1.8494001E-02
168.6164 0.1770320
169.0986 1.562195
169.5807 3.409424
170.0628 4.341614
170.5449 4.535309
171.0270 4.313354
171.5091 3.635742
171.9913 2.726471
172.4734 1.679260
172.9555 0.3680110
173.4376 0.6021420
173.9197 0.5668640
174.4018 0.2464900
174.8840 1.223602
175.3661 2.401184
175.8482 3.396698
176.3303 3.560944
176.8124 2.535309
177.2945 1.292267
177.7767 0.8735960
178.2588 1.148132
178.7409 1.582123
179.2230 2.045471
179.7051 2.414642
180.1872 2.297974
180.6694 1.308624
181.1515 0.4052120
181.6336 1.649261
182.1157 4.663239
182.5978 6.745941
183.0799 4.851044
183.5621 0.4978330
184.0442 2.006500
184.5263 1.306946
185.0084 0.8692630
185.4905 1.598663
185.9726 0.9225160
186.4547 7.1716003E-02
186.9369 0.1610110
187.4190 0.9386900
187.9011 1.342926
188.3832 0.9740910
188.8653 0.1713560
189.3474 0.4927370
189.8296 1.030029
190.3117 1.092621
190.7938 7.5836003E-02
191.2759 2.254456
191.7580 3.578369
192.2401 3.382111
192.7223 2.207764
193.2044 1.727783
193.6865 2.020386
194.1686 2.325439
194.6507 1.675171
195.1328 0.1335750
195.6150 0.7395940
196.0971 0.4402470
196.5792 0.7646180
197.0613 2.000031
197.5434 3.331085
198.0255 4.328278
198.5077 4.289734
198.9898 3.161682
199.4719 2.393890
199.9540 2.407318
200.4361 3.027893
200.9182 3.469971
201.4004 3.707825
201.8825 3.876343
202.3646 4.162384
202.8467 4.586121
203.3288 4.876556
203.8109 4.944092
204.2931 4.815643
204.7752 4.710358
205.2573 4.649506
205.7394 4.564301
206.2215 4.305969
206.7036 3.789673
207.1858 3.564392
207.6679 3.929443
208.1500 4.812897
208.6321 4.962952
209.1142 4.044983
209.5963 3.018738
210.0785 3.049408
210.5606 4.466217
211.0427 5.720245
211.5248 6.546509
212.0069 6.943298
212.4890 6.597168
212.9712 5.181335
213.4533 3.530365
213.9354 2.584351
214.4175 2.496887
214.8996 2.654053
215.3817 3.014404
215.8639 3.572083
216.3460 3.862183
216.8281 3.838043
217.3102 3.602356
217.7923 3.144836
218.2744 2.161957
218.7566 1.755737
219.2387 2.344940
219.7208 3.964661
220.2029 5.246490
220.6850 6.195587
221.1671 6.776154
221.6493 6.923889
222.1314 6.619049
222.6135 5.877747
223.0956 4.502441
223.5777 2.415100
224.0598 1.268921
224.5420 1.368774
225.0241 2.054749
225.5062 2.704132
225.9883 3.425781
226.4704 3.811340
226.9525 3.727875
227.4347 3.129303
227.9168 2.522858
228.3989 1.698975
228.8810 1.088135
229.3631 1.221375
229.8452 2.579071
230.3274 3.748718
230.8095 4.471649
231.2916 4.707428
231.7737 4.591492
232.2558 3.918335
232.7379 3.151062
233.2201 2.848694
233.7022 3.396454
234.1843 3.630432
234.6664 3.202118
235.1485 2.094879
235.6306 1.222107
236.1128 0.4020690
236.5949 1.7700000E-03
237.0770 0.4934690
237.5591 2.583191
238.0412 4.177765
238.5233 4.803864
239.0055 4.465027
239.4876 4.052643
239.9697 3.448395
240.4518 2.893799
240.9339 2.615326
241.4160 2.718536
241.8982 2.764008
242.3803 2.890350
242.8624 3.128632
243.3445 3.275085
243.8266 3.226501
244.3087 3.191925
244.7909 3.366455
245.2730 3.884338
245.7551 4.339600
246.2372 4.675720
246.7193 4.888977
247.2014 5.019897
247.6836 5.186005
248.1657 5.104309
248.6478 4.451111
249.1299 2.520447
249.6120 1.446869
250.0941 1.908020
250.5762 3.620636
251.0584 4.166046
251.5405 2.760010
252.0226 1.236603
252.5047 1.033844
252.9868 3.078918
253.4689 4.192505
253.9511 3.686310
254.4332 1.961700
254.9153 1.380737
255.3974 2.628174
255.8795 3.967712
256.3617 4.224701
256.8438 2.897491
257.3259 1.825195
257.8080 1.160034
258.2901 0.8523250
258.7722 0.6803280
259.2544 0.5503540
259.7365 0.7111510
260.2186 1.378418
260.7007 2.760315
261.1828 4.002319
261.6649 5.161102
262.1471 6.099640
262.6292 6.431641
263.1113 6.013733
263.5934 5.248077
264.0755 4.135193
264.5576 2.312164
265.0398 1.524200
265.5219 2.218384
266.0040 3.703308
266.4861 4.387939
266.9682 4.053101
267.4503 3.467590
267.9325 2.862946
268.4146 2.126221
268.8967 2.006836
269.3788 2.822388
269.8609 4.064728
270.3430 4.531799
270.8252 3.885895
271.3073 3.346100
271.7894 3.578491
272.2715 4.721283
272.7536 5.233795
273.2357 4.903015
273.7179 4.227356
274.2000 3.893372
274.6821 3.886475
275.1642 4.289063
275.6463 5.395599
276.1284 7.231720
276.6106 8.112244
277.0927 7.834045
277.5748 7.077576
278.0569 6.690857
278.5390 6.699860
279.0211 6.660858
279.5032 6.473328
279.9854 6.169525
280.4675 5.874268
280.9496 5.642975
281.4317 5.345642
281.9138 4.619781
282.3959 3.409973
282.8781 2.814270
283.3602 3.398407
283.8423 4.792908
284.3244 5.492310
284.8065 5.506775
285.2886 5.392181
285.7708 5.639832
286.2529 6.231842
286.7350 6.886322
287.2171 7.666534
287.6992 8.433990
288.1813 8.749329
288.6635 8.587280
289.1456 8.200989
289.6277 7.551178
290.1098 6.723389
290.5919 6.301636
291.0740 6.370026
291.5562 6.897278
292.0383 8.354584
292.5204 10.67300
293.0025 12.05292
293.4846 10.53909
293.9667 7.023682
294.4489 4.601715
294.9310 3.731140
295.4131 3.879089
295.8952 4.781799
296.3773 6.274231
296.8594 7.303162
297.3416 6.930603
297.8237 5.717926
298.3058 4.933563
298.7879 4.695923
299.2700 4.741211
299.7521 4.927856
300.2343 5.177979
300.7164 5.210907
301.1985 4.674194
301.6806 3.908173
302.1627 3.296265
302.6448 2.818420
303.1270 2.874512
303.6091 4.355103
304.0912 6.619598
304.5733 8.430969
305.0554 9.220703
305.5375 9.311829
306.0197 8.767303
306.5018 7.629486
306.9839 6.647308
307.4660 6.468018
307.9481 6.776428
308.4302 7.137238
308.9124 7.551483
309.3945 7.845367
309.8766 7.709106
310.3587 7.251160
310.8408 7.020752
311.3229 7.709686
311.8051 8.641479
312.2872 9.081055
312.7693 8.675476
313.2514 8.074310
313.7335 7.659729
314.2156 7.355011
314.6978 6.935760
315.1799 6.234802
315.6620 5.416656
316.1441 4.485535
316.6262 3.185059
317.1083 2.453400
317.5905 3.215515
318.0726 4.748047
318.5547 5.811554
319.0368 5.862366
319.5189 5.407227
320.0010 4.415070
320.4832 2.639465
320.9653 1.629974
321.4474 2.597504
321.9295 4.308685
322.4116 5.320923
322.8937 4.880249
323.3759 4.136292
323.8580 3.289856
324.3401 2.346741
324.8222 1.653076
325.3043 1.648010
325.7864 1.707825
326.2686 1.351318
326.7507 0.3682860
327.2328 1.510193
327.7149 1.589294
328.1970 0.7106320
328.6791 2.6860000E-03
329.1613 0.4824220
329.6434 0.8187870
330.1255 1.052429
330.6076 1.170044
331.0897 1.198730
331.5718 1.156921
332.0540 1.023010
332.5361 0.7407840
333.0182 0.2753910
333.5003 0.2922360
333.9824 1.014465
334.4645 2.143311
334.9467 2.605713
335.4288 2.084961
335.9109 1.117737
336.3930 0.5737300
336.8751 0.4902340
337.3572 0.7395630
337.8394 1.486328
338.3215 2.785828
338.8036 3.158752
339.2857 2.273315
339.7678 1.035706
340.2499 0.6108400
340.7321 1.279846
341.2142 1.069153
341.6963 0.9351810
342.1784 4.108521
342.6605 5.280273
343.1426 4.156860
343.6248 2.330383
344.1069 0.7755740
344.5890 0.4846800
345.0711 0.9882810
345.5532 0.5060420
346.0353 0.5380250
346.5175 1.183472
346.9996 1.448181
347.4817 1.903015
347.9638 3.278870
348.4459 5.190186
348.9280 6.138062
349.4102 5.902100
349.8923 5.166504
350.3744 4.494141
350.8565 3.973145
351.3386 3.953369
351.8207 5.108704
352.3029 6.700684
352.7850 7.462158
353.2671 7.381897
353.7492 7.091858
354.2313 7.073669
354.7134 7.235840
355.1956 7.432800
355.6777 7.684082
356.1598 7.883545
356.6419 7.722473
357.1240 7.328064
357.6061 7.367981
358.0883 8.640747
358.5704 10.36914
359.0525 11.70190
359.5346 12.15759
360.0167 12.80377
360.4988 14.43829
360.9810 16.70978
361.4631 18.83423
361.9452 20.32806
362.4273 21.68713
362.9094 22.82922
363.3915 23.37445
363.8737 25.46472
364.3558 32.34857
364.8379 40.27820
365.3200 44.83197
365.8021 42.00629
366.2842 38.64801
366.7664 36.00983
367.2485 34.13586
367.7306 34.47516
368.2127 39.88318
368.6948 45.90271
369.1769 49.62292
369.6591 47.49866
370.1412 47.36499
370.6233 50.50800
371.1054 56.05957
371.5875 60.65387
372.0696 62.84723
372.5518 65.76660
373.0339 70.73724
373.5160 78.18274
373.9981 86.58545
374.4802 96.17542
374.9623 106.6404
375.4445 117.5114
375.9266 129.2478
376.4087 140.4953
376.8908 151.4054
377.3729 161.9350
377.8550 169.7314
378.3372 175.8065
378.8193 176.2524
379.3014 165.5231
379.7835 143.0535
380.2656 119.2874
380.7477 94.64935
381.2299 71.39447
381.7120 55.57941
382.1941 47.41626
382.6762 42.16559
383.1583 37.27002
383.6404 32.81299
384.1226 29.39648
384.6047 27.14368
385.0868 25.44623
385.5689 23.58929
386.0510 21.76147
386.5331 20.40961
387.0153 20.23346
387.4974 20.40857
387.9795 19.49817
388.4616 17.49738
388.9437 15.79169
389.4258 15.67145
389.9080 16.47748
390.3901 17.28595
390.8722 17.93958
391.3543 18.32605
391.8364 18.37982
392.3185 18.06860
392.8007 17.42682
393.2828 15.76117
393.7649 14.32916
394.2470 14.09204
394.7291 15.57043
395.2112 17.06177
395.6934 17.57104
396.1755 17.72321
396.6576 18.56787
397.1397 20.09387
397.6218 22.74658
398.1039 26.98633
398.5861 32.91443
399.0682 38.45428
399.5503 43.87390
400.0324 48.60040
400.5145 52.20325
400.9966 53.68134
401.4788 55.50415
401.9609 58.05066
402.4430 61.04669
402.9251 63.48108
403.4072 64.71472
403.8893 66.55365
404.3714 69.85712
404.8535 75.04327
405.3357 79.91864
405.8178 84.06555
406.2999 88.36011
406.7820 94.25439
407.2641 102.1599
407.7462 110.0009
408.2284 116.5979
408.7105 122.3866
409.1926 129.9608
409.6747 139.2560
410.1568 150.8470
410.6389 164.9765
411.1211 181.6545
411.6032 201.6592
412.0853 225.2805
412.5674 252.2864
413.0495 283.8929
413.5316 319.7174
414.0138 356.8981
414.4959 395.9907
414.9780 435.2692
415.4601 475.9966
415.9422 519.5554
416.4243 548.5483
416.9065 551.7831
417.3886 530.8840
417.8707 487.7112
418.3528 403.4083
418.8349 315.5699
419.3170 243.3110
419.7992 185.5715
420.2813 140.6154
420.7634 110.6913
421.2455 89.90247
421.7276 74.98541
422.2097 66.93671
422.6919 60.66266
423.1740 54.76276
423.6561 49.85034
424.1382 46.74213
424.6203 46.91144
425.1024 47.62683
425.5846 48.29755
426.0667 48.89545
426.5488 49.74487
427.0309 51.02289
427.5130 52.41223
427.9951 53.78485
428.4773 55.53674
428.9594 56.45355
429.4415 56.59314
429.9236 55.79779
430.4057 53.39313
430.8878 48.91705
431.3700 44.30487
431.8521 40.44537
432.3342 37.34351
432.8163 33.86200
433.2984 29.83734
433.7805 26.02179
434.2627 23.17114
434.7448 21.27087
435.2269 20.35071
435.7090 21.01135
436.1911 22.02435
436.6732 20.50946
437.1554 16.74756
437.6375 13.05798
438.1196 10.88312
438.6017 9.805603
439.0838 9.169983
439.5659 8.890991
440.0481 9.085266
440.5302 10.28040
441.0123 11.95337
441.4944 13.22961
441.9765 13.49683
442.4586 13.50049
442.9408 13.51550
443.4229 13.56354
443.9050 13.87231
444.3871 14.80048
444.8692 15.90405
445.3513 16.89990
445.8335 17.76520
446.3156 18.48364
446.7977 19.39471
447.2798 20.09784
447.7619 19.85718
448.2440 17.39600
448.7262 15.40210
449.2083 14.80945
449.6904 15.69013
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