#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:43:28 +0300 (Thu, 07 Jun 2018) $
#$Revision: 957 $
#$URL: svn://172.16.1.111/rod/cif/8/10/00/8100029.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_8100029
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        R110119
_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            R110119.rod
_rod_data_source.block           3500000
_rod_database.code               8100029
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
186.4334 0.0000000E+00
186.9155 0.7478640
187.3976 0.6774290
187.8798 0.9580080
188.3619 2.026611
188.8440 3.022034
189.3261 3.757263
189.8082 6.013733
190.2903 7.138123
190.7725 7.339783
191.2546 7.462646
191.7367 6.590271
192.2188 3.815979
192.7009 0.6409910
193.1830 0.7246700
193.6652 0.2861330
194.1473 0.6421510
194.6294 1.642090
195.1115 2.662964
195.5936 2.856812
196.0757 1.885742
196.5579 0.5675050
197.0400 0.5616460
197.5221 1.954773
198.0042 3.654053
198.4863 5.270386
198.9684 6.804749
199.4506 7.639893
199.9327 7.450134
200.4148 6.898071
200.8969 7.556702
201.3790 9.630554
201.8611 11.87079
202.3433 13.67120
202.8254 15.04199
203.3075 15.85901
203.7896 15.91797
204.2717 15.57556
204.7538 15.91315
205.2360 17.19977
205.7181 18.13593
206.2002 17.67310
206.6823 15.48376
207.1644 13.95514
207.6465 13.28442
208.1287 13.36646
208.6108 14.16931
209.0929 16.12000
209.5750 17.60583
210.0571 17.45569
210.5392 15.31244
211.0214 13.22369
211.5035 11.25006
211.9856 9.501831
212.4677 8.313965
212.9498 7.782715
213.4319 7.637817
213.9140 7.875610
214.3962 8.766541
214.8783 9.052979
215.3604 8.405457
215.8425 7.113281
216.3246 6.418030
216.8067 6.637390
217.2889 6.822083
217.7710 6.093445
218.2531 3.580811
218.7352 2.859131
219.2173 5.012756
219.6994 9.194153
220.1816 11.21246
220.6637 10.28870
221.1458 8.599243
221.6279 7.438843
222.1100 6.873169
222.5921 6.625183
223.0743 6.761719
223.5564 7.205078
224.0385 7.672852
224.5206 8.383667
225.0027 8.785156
225.4848 8.364624
225.9670 6.413635
226.4491 5.460388
226.9312 6.156921
227.4133 8.036255
227.8954 8.940430
228.3775 8.385315
228.8597 7.561340
229.3418 7.175415
229.8239 7.369873
230.3060 7.685974
230.7881 8.323181
231.2702 9.071228
231.7524 8.820251
232.2345 6.950195
232.7166 4.931519
233.1987 3.610596
233.6808 3.137756
234.1629 2.999695
234.6451 3.215576
235.1272 3.735474
235.6093 4.429810
236.0914 5.593933
236.5735 6.572937
237.0556 6.982483
237.5378 6.583496
238.0199 5.702637
238.5020 3.995605
238.9841 1.821045
239.4662 0.6777340
239.9483 0.9545290
240.4305 2.061829
240.9126 3.507568
241.3947 5.791260
241.8768 6.999573
242.3589 6.679260
242.8410 5.254517
243.3232 4.116455
243.8053 2.981812
244.2874 2.564697
244.7695 3.200500
245.2516 5.178711
245.7337 7.657532
246.2159 11.44757
246.6980 15.60413
247.1801 16.83032
247.6622 13.51544
248.1443 9.692444
248.6264 7.279663
249.1086 6.757385
249.5907 6.457886
250.0728 6.414368
250.5549 6.545410
251.0370 6.720581
251.5191 7.353699
252.0013 7.649414
252.4834 7.098267
252.9655 5.101013
253.4476 3.855164
253.9297 3.549194
254.4118 3.908569
254.8940 4.427246
255.3761 5.402588
255.8582 6.209595
256.3403 6.295715
256.8224 5.289307
257.3046 4.385437
257.7867 3.530090
258.2688 2.842163
258.7509 2.628784
259.2330 3.117126
259.7151 3.635742
260.1973 3.731689
260.6794 3.211914
261.1615 3.456299
261.6436 4.989685
262.1257 6.835999
262.6078 7.114502
263.0900 5.011902
263.5721 3.337463
264.0542 3.408447
264.5363 5.769043
265.0184 6.453003
265.5005 4.949402
265.9827 2.522949
266.4648 0.9058840
266.9469 0.2227780
267.4290 3.6437999E-02
267.9111 0.2871700
268.3932 0.9906620
268.8754 1.815125
269.3575 2.866028
269.8396 3.846985
270.3217 4.277039
270.8038 4.095825
271.2859 4.105713
271.7681 4.533630
272.2502 5.297729
272.7323 5.424255
273.2144 4.715820
273.6965 3.874695
274.1786 3.633484
274.6608 4.105896
275.1429 4.627930
275.6250 4.926025
276.1071 5.076233
276.5892 5.287659
277.0714 5.578613
277.5535 5.877380
278.0356 6.121765
278.5177 6.339355
278.9998 6.301331
279.4819 5.860291
279.9641 5.141907
280.4462 4.719116
280.9283 4.624390
281.4104 4.673035
281.8925 4.933105
282.3746 5.421326
282.8568 5.096924
283.3389 3.414978
283.8210 1.135376
284.3031 0.7254640
284.7852 2.436340
285.2673 4.028259
285.7495 3.556152
286.2316 1.250732
286.7137 0.2769780
287.1958 0.5683590
287.6779 4.1443001E-02
288.1600 0.5687870
288.6422 1.361145
289.1243 2.135559
289.6064 2.716125
290.0885 3.202759
290.5706 3.639954
291.0527 4.090942
291.5349 4.298767
292.0170 3.692627
292.4991 2.332886
292.9812 0.9237060
293.4633 0.3261720
293.9454 1.320313
294.4276 1.730347
294.9097 1.534729
295.3918 0.7621460
295.8739 0.8426510
296.3560 3.106750
296.8381 5.288757
297.3203 7.077148
297.8024 8.514709
298.2845 9.755615
298.7666 10.82764
299.2487 11.50616
299.7308 11.58264
300.2130 11.09638
300.6951 10.14679
301.1772 8.276428
301.6593 6.212585
302.1414 5.090332
302.6235 4.897583
303.1057 4.908386
303.5878 4.330017
304.0699 3.548828
304.5520 3.309570
305.0341 4.168823
305.5162 5.383301
305.9984 6.401245
306.4805 7.176941
306.9626 7.469543
307.4447 6.906250
307.9268 5.817749
308.4089 4.570740
308.8911 3.013123
309.3732 1.706055
309.8553 1.178894
310.3374 1.300232
310.8195 1.626099
311.3016 2.533997
311.7838 3.202087
312.2659 2.632751
312.7480 8.8196002E-02
313.2301 2.328735
313.7122 2.080261
314.1943 0.2245480
314.6765 1.378235
315.1586 1.965698
315.6407 1.989014
316.1228 1.464111
316.6049 0.1020510
317.0870 0.5203860
317.5692 1.326782
318.0513 4.111877
318.5334 5.678406
319.0155 4.048706
319.4976 2.159424
319.9797 1.380432
320.4619 1.904114
320.9440 2.272400
321.4261 0.7288210
321.9082 0.6171880
322.3903 0.2432250
322.8724 7.889648
323.3546 13.58325
323.8367 14.15643
324.3188 9.764038
324.8009 6.006653
325.2830 3.902344
325.7651 2.679199
326.2473 1.846191
326.7294 2.230530
327.2115 2.018311
327.6936 0.4733890
328.1757 1.987549
328.6578 3.389526
329.1400 3.269897
329.6221 2.436035
330.1042 1.112610
330.5863 1.882446
331.0684 3.381836
331.5505 2.402527
332.0327 8.9844003E-02
332.5148 0.9589230
332.9969 0.2067260
333.4790 1.312256
333.9611 1.458984
334.4432 0.2009280
334.9254 0.2910160
335.4075 0.2789310
335.8896 1.329590
336.3717 2.081726
336.8538 2.439819
337.3359 2.675903
337.8180 2.809753
338.3001 2.845764
338.7823 3.123596
339.2644 3.858826
339.7465 4.436218
340.2286 4.091980
340.7107 2.633057
341.1928 1.526123
341.6750 1.188843
342.1571 1.391479
342.6392 1.065796
343.1213 4.9927000E-02
343.6034 0.6175540
344.0855 0.4348750
344.5677 3.025757
345.0498 3.637634
345.5319 1.220093
346.0140 2.201416
346.4961 2.239075
346.9782 0.9573970
347.4604 3.841858
347.9425 3.991455
348.4246 2.126343
348.9067 0.6776120
349.3888 0.2848510
349.8709 0.5457150
350.3531 0.7677000
350.8352 3.179443
351.3173 4.866577
351.7994 4.393738
352.2815 2.976013
352.7636 2.789368
353.2458 3.862427
353.7279 5.004639
354.2100 4.838623
354.6921 3.986145
355.1742 3.545898
355.6563 4.067505
356.1385 4.901306
356.6206 5.503784
357.1027 5.898987
357.5848 6.199585
358.0669 6.211731
358.5490 6.300232
359.0312 6.853455
359.5133 8.112305
359.9954 9.503235
360.4775 10.54932
360.9596 11.50494
361.4417 12.87903
361.9239 15.52820
362.4060 18.18127
362.8881 20.04688
363.3702 20.89062
363.8523 21.79572
364.3344 23.15063
364.8166 24.74170
365.2987 26.34070
365.7808 27.81445
366.2629 29.32446
366.7450 30.83588
367.2271 32.35199
367.7093 34.14697
368.1914 36.46246
368.6735 38.92426
369.1556 41.30286
369.6377 42.94519
370.1198 45.22125
370.6020 48.14398
371.0841 51.58252
371.5662 55.60181
372.0483 59.40125
372.5304 64.80408
373.0125 72.84875
373.4947 84.56012
373.9768 95.64618
374.4589 105.2858
374.9410 115.0416
375.4231 127.6132
375.9052 143.9072
376.3874 160.7017
376.8695 177.6713
377.3516 194.9415
377.8337 209.3917
378.3158 222.5464
378.7979 229.4894
379.2801 225.0002
379.7622 208.7961
380.2443 184.7501
380.7264 150.0923
381.2085 110.5701
381.6906 80.85645
382.1728 61.09302
382.6549 47.06317
383.1370 37.45972
383.6191 31.60327
384.1012 27.57013
384.5833 25.42194
385.0655 23.95923
385.5476 21.12207
386.0297 17.32800
386.5118 14.74689
386.9939 15.52240
387.4760 17.83368
387.9582 18.96265
388.4403 18.83838
388.9224 18.49219
389.4045 19.00757
389.8866 19.82324
390.3687 20.06091
390.8509 18.99982
391.3330 17.93903
391.8151 17.68488
392.2972 18.20789
392.7793 19.33978
393.2614 21.79584
393.7436 24.35004
394.2257 26.04895
394.7078 26.19958
395.1899 26.73468
395.6720 28.11731
396.1541 30.34296
396.6363 33.40912
397.1184 37.63171
397.6005 42.38898
398.0826 46.80664
398.5647 50.44489
399.0468 57.29596
399.5290 68.10925
400.0111 82.09564
400.4932 98.68719
400.9753 120.5493
401.4574 141.4904
401.9395 160.9905
402.4217 179.1318
402.9038 195.8666
403.3859 210.6111
403.8680 224.8382
404.3501 239.0983
404.8322 253.0481
405.3144 268.7207
405.7965 286.4975
406.2786 305.3147
406.7607 322.9013
407.2428 338.6804
407.7249 356.2961
408.2071 375.9125
408.6892 398.1125
409.1713 425.8209
409.6534 458.8082
410.1355 499.1364
410.6176 549.7168
411.0998 609.8842
411.5819 676.3232
412.0640 752.6315
412.5461 827.8860
413.0282 882.1959
413.5103 918.4163
413.9925 954.7220
414.4746 999.8559
414.9567 1052.923
415.4388 1119.109
415.9209 1202.546
416.4030 1270.721
416.8852 1308.935
417.3673 1312.357
417.8494 1273.881
418.3315 1176.512
418.8136 1048.318
419.2957 888.6374
419.7779 705.5571
420.2600 540.7404
420.7421 411.9681
421.2242 310.4041
421.7063 234.0110
422.1884 187.3500
422.6706 152.7693
423.1527 129.1712
423.6348 114.1072
424.1169 102.7526
424.5990 96.18152
425.0811 91.33472
425.5633 87.48010
426.0454 84.61011
426.5275 82.43127
427.0096 80.36200
427.4917 79.41656
427.9738 80.74225
428.4560 86.30225
428.9381 89.97217
429.4202 91.25848
429.9023 90.14508
430.3844 86.14203
430.8665 78.48059
431.3487 70.16998
431.8308 62.42065
432.3129 55.23828
432.7950 49.28137
433.2771 44.80957
433.7592 40.97449
434.2414 36.54175
434.7235 31.59106
435.2056 26.97455
435.6877 22.81305
436.1698 19.28467
436.6519 16.77783
437.1341 15.28632
437.6162 14.48596
438.0983 14.79913
438.5804 15.47955
439.0625 15.08765
439.5446 13.14368
440.0268 10.94013
440.5089 9.469666
440.9910 8.588257
441.4731 8.017761
441.9552 7.679932
442.4373 7.555786
442.9195 7.771240
443.4016 8.303040
443.8837 8.597046
444.3658 8.296265
444.8479 7.718628
445.3300 7.080261
445.8122 5.567200
446.2943 5.092041
446.7764 7.077393
447.2585 10.41071
447.7406 12.11377
448.2227 10.59460
448.7049 8.794739
449.1870 7.543579
449.6691 6.912720
450.1512 5.873535
450.6333 4.114075
451.1154 2.513184
451.5976 2.070923
452.0797 3.262878
452.5618 4.043518
453.0439 4.021240
453.5260 3.456299
454.0081 3.131714
454.4903 3.077576
454.9724 3.097351
455.4545 3.144409
455.9366 3.196106
456.4187 2.961670
456.9008 2.333740
457.3830 1.847229
457.8651 2.590027
458.3472 4.074219
458.8293 4.648926
459.3114 3.367432
459.7935 1.329895
460.2757 0.5614010
460.7578 2.157410
461.2399 2.750732
461.7220 0.8429570
462.2041 1.718872
462.6862 3.135132
463.1684 3.046936
463.6505 2.406860
464.1326 1.483337
464.6147 0.3757320
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466.0611 3.881592
466.5432 3.956543
467.0253 2.942200
467.5074 1.827515
467.9895 0.4752810
468.4716 0.7630000
468.9538 1.710510
469.4359 2.274353
469.9180 2.730164
470.4001 3.167725
470.8822 3.425293
471.3643 3.232727
471.8465 2.466980
472.3286 1.511597
472.8107 0.1456300
473.2928 1.361877
473.7749 1.105530
474.2570 1.252991
474.7392 3.568481
475.2213 3.963379
475.7034 2.745605
476.1855 2.079163
476.6676 2.245850
477.1497 2.830627
477.6319 3.582581
478.1140 4.306763
478.5961 4.569458
479.0782 3.716248
479.5603 2.603943
480.0424 2.409485
480.5246 2.980225
481.0067 3.443970
481.4888 3.165466
481.9709 2.702209
482.4530 2.586548
482.9352 3.191040
483.4173 3.446838
483.8994 2.525574
484.3815 1.064819
484.8636 5.2979000E-02
485.3457 0.1557010
485.8279 3.6986999E-02
486.3100 0.5181880
486.7921 1.505920
487.2742 1.938293
487.7563 1.220520
488.2384 0.5823360
488.7206 0.8193360
489.2027 2.532654
489.6848 3.512390
490.1669 3.585632
490.6490 3.094299
491.1311 2.325745
491.6133 1.128845
492.0954 0.7720340
492.5775 1.902039
493.0596 4.096313
493.5417 6.202637
494.0238 8.223511
494.5060 9.184143
494.9881 7.150879
495.4702 3.541260
495.9523 2.071533
496.4344 3.490112
496.9165 5.822205
497.3987 7.817017
497.8808 9.255127
498.3629 9.680481
498.8450 8.097656
499.3271 6.136475
499.8092 4.616272
500.2914 3.562073
500.7735 3.135498
501.2556 4.051147
501.7377 5.134094
502.2198 5.771423
502.7019 6.002563
503.1841 5.550537
503.6662 3.709961
504.1483 1.458313
504.6304 5.4504000E-02
505.1125 0.4667360
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