#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:54:37 +0300 (Thu, 07 Jun 2018) $
#$Revision: 1010 $
#$URL: svn://172.16.1.111/rod/cif/8/10/00/8100033.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_8100033
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 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            R100131.rod
_rod_data_source.block           3500000
_rod_database.code               8100033
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
157.0852 0.0000000E+00
157.5673 1.307396
158.0495 3.144409
158.5316 4.511848
159.0137 4.484680
159.4958 4.767525
159.9779 6.073364
160.4600 7.865158
160.9422 8.368637
161.4243 6.424858
161.9064 3.035515
162.3885 0.8543850
162.8706 1.808823
163.3527 2.909111
163.8349 2.872246
164.3170 1.892494
164.7991 0.9089430
165.2812 0.7019810
165.7633 1.663124
166.2454 0.7771380
166.7276 3.982666
167.2097 9.174400
167.6918 12.79742
168.1739 14.96762
168.6560 16.97105
169.1381 19.26785
169.6203 21.85269
170.1024 23.95515
170.5845 26.92453
171.0666 29.63961
171.5487 30.43876
172.0309 29.47488
172.5130 28.67916
172.9951 30.05661
173.4772 32.37459
173.9593 33.70976
174.4414 32.49426
174.9236 30.38428
175.4057 29.21451
175.8878 28.98730
176.3699 28.89896
176.8520 27.97961
177.3341 26.67708
177.8163 25.97468
178.2984 27.26746
178.7805 29.06919
179.2626 28.91917
179.7447 26.67372
180.2268 23.83092
180.7090 21.73492
181.1911 20.24738
181.6732 18.98194
182.1553 17.53564
182.6374 16.21637
183.1195 15.82607
183.6017 16.46468
184.0838 17.51838
184.5659 18.49734
185.0480 19.35911
185.5301 19.93584
186.0123 19.94685
186.4944 19.58498
186.9765 19.48951
187.4586 19.72747
187.9407 20.05982
188.4228 20.09319
188.9050 19.86039
189.3871 19.73447
189.8692 20.00883
190.3513 20.58280
190.8334 20.94707
191.3155 21.04118
191.7977 21.01534
192.2798 21.13696
192.7619 21.40690
193.2440 21.59770
193.7261 21.69765
194.2082 21.68105
194.6904 21.11771
195.1725 19.81944
195.6546 18.29555
196.1367 17.68395
196.6188 18.05984
197.1009 18.30441
197.5831 17.52161
198.0652 15.71304
198.5473 14.91513
199.0294 15.51878
199.5115 16.77861
199.9937 17.05931
200.4758 16.19954
200.9579 15.35784
201.4400 15.31770
201.9221 16.16672
202.4042 16.52596
202.8864 16.20152
203.3685 15.46394
203.8506 14.92326
204.3327 14.60043
204.8148 14.39500
205.2969 14.23789
205.7791 14.11132
206.2612 14.15432
206.7433 14.37507
207.2254 14.76715
207.7075 15.45584
208.1896 16.67253
208.6718 17.52168
209.1539 17.39157
209.6360 16.05599
210.1181 14.86948
210.6002 13.81657
211.0823 13.00272
211.5645 12.82291
212.0466 13.51454
212.5287 14.28598
213.0108 14.74267
213.4929 14.87328
213.9750 14.73019
214.4572 14.18071
214.9393 13.33196
215.4214 12.83514
215.9035 12.75370
216.3856 12.88379
216.8678 13.19554
217.3499 13.86906
217.8320 14.09514
218.3141 13.60454
218.7962 12.70273
219.2783 12.46306
219.7605 13.35802
220.2426 14.06057
220.7247 13.69905
221.2068 11.64079
221.6889 10.36452
222.1710 10.25847
222.6532 10.93749
223.1353 11.15746
223.6174 10.70594
224.0995 10.20192
224.5816 9.925774
225.0637 10.00326
225.5459 9.878296
226.0280 9.352615
226.5101 8.653999
226.9922 8.552116
227.4743 9.432594
227.9564 10.30255
228.4386 10.65727
228.9207 10.21926
229.4028 9.912094
229.8849 9.762154
230.3670 9.746086
230.8492 9.831299
231.3313 10.14733
231.8134 10.36506
232.2955 10.29305
232.7776 9.689522
233.2597 9.388657
233.7419 9.585999
234.2240 10.03982
234.7061 10.03427
235.1882 9.095810
235.6703 8.421555
236.1524 8.587112
236.6346 10.07694
237.1167 11.33034
237.5988 12.44598
238.0809 13.30104
238.5630 13.58799
239.0451 13.01566
239.5273 12.26832
240.0094 11.53212
240.4915 10.54037
240.9736 10.32931
241.4557 11.36025
241.9378 12.97378
242.4200 13.70164
242.9021 12.93832
243.3842 12.21872
243.8663 12.14666
244.3484 12.97652
244.8306 13.72112
245.3127 14.49323
245.7948 15.11566
246.2769 15.20219
246.7590 14.45564
247.2411 13.67898
247.7233 13.15851
248.2054 12.97933
248.6875 12.72093
249.1696 12.24531
249.6517 11.78596
250.1338 11.84195
250.6160 13.00859
251.0981 13.60387
251.5802 12.84196
252.0623 10.25109
252.5444 8.790421
253.0265 8.954697
253.5087 9.860672
253.9908 10.23299
254.4729 9.871445
254.9550 9.410172
255.4371 8.977333
255.9192 8.555748
256.4014 8.320694
256.8835 8.266724
257.3656 8.405289
257.8477 8.848854
258.3298 9.918999
258.8120 10.56621
259.2941 10.46938
259.7762 9.583733
260.2583 8.538933
260.7404 6.899872
261.2225 5.625137
261.7047 6.008636
262.1868 9.020851
262.6689 11.12730
263.1510 11.33849
263.6331 9.719414
264.1152 8.443802
264.5974 7.592567
265.0795 6.972900
265.5616 6.375893
266.0437 5.680946
266.5258 5.416618
267.0079 5.852448
267.4901 6.876030
267.9722 7.414162
268.4543 7.367798
268.9364 6.993912
269.4185 6.421829
269.9006 5.591232
270.3828 4.857590
270.8649 4.239075
271.3470 3.804199
271.8291 4.012848
272.3112 5.077759
272.7933 6.133087
273.2755 6.449142
273.7576 6.026917
274.2397 5.650192
274.7218 5.255035
275.2039 4.859467
275.6860 4.546776
276.1682 4.399773
276.6503 4.197433
277.1324 3.709969
277.6145 2.886047
278.0966 2.399269
278.5787 2.337151
279.0609 2.522278
279.5430 2.466377
280.0251 2.116669
280.5072 2.046776
280.9893 2.773674
281.4715 4.256340
281.9536 5.405716
282.4357 6.131897
282.9178 6.408585
283.3999 5.731224
283.8820 4.035110
284.3642 2.696434
284.8463 2.590683
285.3284 3.559883
285.8105 4.095947
286.2926 4.089226
286.7747 3.911385
287.2569 4.184120
287.7390 4.871368
288.2211 5.037903
288.7032 3.874313
289.1853 1.812279
289.6674 0.9361270
290.1496 1.439537
290.6317 2.285477
291.1138 2.222183
291.5959 1.352478
292.0780 0.5698170
292.5602 0.1736220
293.0423 0.1408620
293.5244 0.5154880
294.0065 1.322960
294.4886 1.912727
294.9707 1.427628
295.4529 0.1712950
295.9350 0.7444840
296.4171 0.9705050
296.8992 0.7659990
297.3813 0.4579320
297.8634 6.5932997E-02
298.3456 0.1995540
298.8277 7.0418999E-02
299.3098 0.5777970
299.7919 0.5908130
300.2740 0.2349550
300.7561 1.267380
301.2383 1.686523
301.7204 1.576767
302.2025 1.282669
302.6846 0.8382570
303.1667 0.4007110
303.6488 0.1985320
304.1310 0.2754210
304.6131 0.5674590
305.0952 1.244064
305.5773 2.120117
306.0594 2.693802
306.5415 2.317429
307.0237 1.697495
307.5058 1.744797
307.9879 2.663620
308.4700 3.404266
308.9521 2.938324
309.4343 1.768204
309.9164 0.7755890
310.3985 3.1890001E-03
310.8806 0.2252350
311.3627 0.7292330
311.8448 2.916595
312.3270 4.649765
312.8091 4.539810
313.2912 3.531830
313.7733 2.742645
314.2554 2.782227
314.7375 2.955002
315.2197 2.780121
315.7018 2.327026
316.1839 2.207779
316.6660 3.341782
317.1481 4.595047
317.6302 5.008392
318.1124 3.735565
318.5945 2.372986
319.0766 1.271332
319.5587 0.4631500
320.0408 3.6697000E-02
320.5229 0.3258510
321.0051 0.7891390
321.4872 1.124023
321.9693 1.195358
322.4514 1.295609
322.9335 1.677872
323.4156 2.114273
323.8978 2.165375
324.3799 1.290787
324.8620 0.4239350
325.3441 0.1034700
325.8262 0.1882320
326.3083 0.1721340
326.7905 0.1517490
327.2726 0.4887540
327.7547 0.4725950
328.2368 0.7414550
328.7189 1.436462
329.2010 0.8863830
329.6832 1.127258
330.1653 1.870483
330.6474 0.1651150
331.1295 1.962219
331.6116 2.835098
332.0938 1.457687
332.5759 0.4062960
333.0580 5.5861998E-02
333.5401 0.3228150
334.0222 0.6478880
334.5043 1.202805
334.9865 1.585007
335.4686 1.483429
335.9507 0.6037140
336.4328 3.3920001E-02
336.9149 0.1643370
337.3970 2.4383999E-02
337.8792 0.5330810
338.3613 1.846664
338.8434 2.646027
339.3255 2.067520
339.8076 0.1956790
340.2898 1.440598
340.7719 1.483002
341.2540 0.8539430
341.7361 0.1168370
342.2182 0.7868350
342.7003 1.130219
343.1825 0.4977110
343.6646 0.9651030
344.1467 2.401276
344.6288 3.910324
345.1109 4.955414
345.5930 4.838394
346.0752 3.648819
346.5573 2.262115
347.0394 0.6747740
347.5215 0.8075870
348.0036 1.530930
348.4857 1.496964
348.9679 0.9658360
349.4500 7.2600998E-02
349.9321 1.480209
350.4142 2.947754
350.8963 4.577255
351.3784 5.890030
351.8606 5.863876
352.3427 4.846024
352.8248 4.120392
353.3069 4.818039
353.7890 6.069702
354.2711 6.729752
354.7533 6.694916
355.2354 6.368958
355.7175 5.793274
356.1996 5.183411
356.6817 4.923126
357.1638 5.379868
357.6460 6.091095
358.1281 6.641174
358.6102 7.043671
359.0923 7.734634
359.5744 9.327118
360.0565 11.15889
360.5387 12.57068
361.0208 13.04125
361.5029 13.48775
361.9850 14.23352
362.4671 15.25804
362.9492 16.49274
363.4314 18.24208
363.9135 19.95711
364.3956 21.28519
364.8777 21.95982
365.3598 22.78923
365.8419 24.08313
366.3241 25.60358
366.8062 26.98492
367.2883 27.72702
367.7704 28.75763
368.2526 30.45032
368.7347 32.97273
369.2168 35.21954
369.6989 36.82202
370.1810 38.35681
370.6631 40.31355
371.1453 42.81165
371.6274 45.53888
372.1095 48.24844
372.5916 51.10680
373.0737 55.09839
373.5558 60.48384
374.0380 66.66084
374.5201 73.27599
375.0022 79.96744
375.4843 88.20865
375.9664 98.60162
376.4485 110.0751
376.9307 121.1423
377.4128 132.0133
377.8949 141.2560
378.3770 149.1481
378.8591 155.4647
379.3412 155.5981
379.8234 149.1701
380.3055 137.8921
380.7876 122.0522
381.2697 101.8500
381.7518 83.08429
382.2339 66.83257
382.7161 53.34402
383.1982 43.59209
383.6803 37.59576
384.1624 33.04428
384.6445 28.28763
385.1266 23.73550
385.6088 20.53595
386.0909 18.98927
386.5730 18.19487
387.0551 17.40323
387.5372 16.67525
388.0193 15.95253
388.5015 15.00301
388.9836 14.05852
389.4657 13.71263
389.9478 14.15428
390.4299 14.59796
390.9120 14.32201
391.3942 13.71065
391.8763 13.28079
392.3584 13.36882
392.8405 13.51532
393.3226 13.44283
393.8047 13.27631
394.2869 13.34222
394.7690 13.94307
395.2511 14.64464
395.7332 15.13004
396.2154 15.10310
396.6975 15.26924
397.1796 15.76784
397.6617 16.76231
398.1438 18.22379
398.6259 20.09775
399.1081 22.44302
399.5902 25.39088
400.0723 29.04094
400.5544 32.57755
401.0365 36.14117
401.5186 39.60793
402.0008 42.77046
402.4829 45.84122
402.9650 48.12627
403.4471 48.93120
403.9292 48.90182
404.4113 50.87315
404.8935 55.48868
405.3756 60.52130
405.8577 64.91216
406.3398 68.56680
406.8219 72.29106
407.3040 75.92909
407.7862 80.03989
408.2683 85.51198
408.7504 92.35970
409.2325 100.0613
409.7146 108.4933
410.1967 117.6164
410.6789 127.1279
411.1610 136.9890
411.6431 149.5511
412.1252 166.5704
412.6073 187.7882
413.0894 212.6418
413.5716 240.7269
414.0537 271.8351
414.5358 307.2296
415.0179 345.4745
415.5000 383.1320
415.9821 423.4768
416.4643 459.0009
416.9464 484.4296
417.4285 499.5948
417.9106 496.6610
418.3927 464.9130
418.8748 414.0368
419.3570 356.1652
419.8391 281.7791
420.3212 213.8106
420.8033 160.6348
421.2854 121.5387
421.7675 91.60872
422.2497 72.90500
422.7318 60.26154
423.2139 51.60669
423.6960 48.14891
424.1781 45.47777
424.6602 43.22728
425.1424 41.50935
425.6245 40.49701
426.1066 39.90862
426.5887 40.40895
427.0709 42.61945
427.5530 46.53731
428.0351 49.25676
428.5172 50.42038
428.9993 50.90977
429.4814 51.52794
429.9636 52.67740
430.4457 52.32755
430.9278 50.09019
431.4099 46.48412
431.8920 42.44615
432.3741 37.87167
432.8563 33.40527
433.3384 29.35809
433.8205 25.66391
434.3026 21.80432
434.7847 17.66373
435.2668 14.11407
435.7490 12.41438
436.2311 12.11681
436.7132 11.66306
437.1953 10.51410
437.6774 9.202957
438.1595 8.421570
438.6417 8.153076
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439.6059 7.955246
440.0880 7.877213
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441.0522 7.810394
441.5344 7.840546
442.0165 8.053604
442.4986 8.285660
442.9807 8.334366
443.4628 7.909409
443.9449 7.589462
444.4271 7.360153
444.9092 7.293259
445.3913 7.897644
445.8734 10.16995
446.3555 12.50598
446.8376 14.10071
447.3198 14.66368
447.8019 15.07616
448.2840 15.07022
448.7661 14.91457
449.2482 15.14183
449.7303 16.98482
450.2125 17.37874
450.6946 15.09933
451.1767 10.40640
451.6588 7.317307
452.1409 6.080246
452.6230 5.809433
453.1052 6.287567
453.5873 7.589005
454.0694 7.829025
454.5515 6.674301
455.0337 4.806351
455.5158 3.263748
455.9979 2.024750
456.4800 0.9560700
456.9621 0.2094570
457.4442 1.193542
457.9264 1.158737
458.4085 0.1392210
458.8906 1.001297
459.3727 1.740753
459.8548 2.090622
460.3369 1.956909
460.8191 1.097870
461.3012 0.2904210
461.7833 0.3083950
462.2654 0.8361510
462.7475 1.214905
463.2296 0.9735720
463.7118 0.6622620
464.1939 0.6625370
464.6760 0.9832610
465.1581 1.157532
465.6402 1.173096
466.1223 1.009140
466.6045 0.6456760
467.0866 0.9105830
467.5687 1.440048
468.0508 0.1477660
468.5329 2.177261
469.0150 3.837357
469.4972 4.763535
469.9793 5.089310
470.4614 4.683670
470.9435 3.495483
471.4256 2.607803
471.9077 2.016800
472.3899 1.738998
472.8720 1.986465
473.3541 2.853210
473.8362 3.033295
474.3183 2.055450
474.8004 0.7690890
475.2826 1.269897
475.7647 3.398758
476.2468 4.902390
476.7289 3.902191
477.2110 1.602478
477.6931 0.7367400
478.1753 1.318359
478.6574 2.386673
479.1395 3.615799
479.6216 4.696121
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