#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 11:41:34 +0300 (Thu, 07 Jun 2018) $
#$Revision: 1232 $
#$URL: svn://172.16.1.111/rod/cif/1/00/06/1000644.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_1000644
loop_
_publ_author_name
'Moore, P. B.'
'Araki, T.'
_publ_section_title
;
 Bahianite, Al5Sb3O14(O,OH)2, a novel hexagonal close-packed oxide
 structure Locality: Serra de Mangabeira, Bahia, Brazil
;
_journal_name_full
'Neues Jahrbuch fur Mineralogie, Abhandlungen'
_journal_page_first              113
_journal_page_last               125
_journal_volume                  126
_journal_year                    1976
_chemical_compound_source        R060433
_chemical_formula_sum            'Al4.76 Fe0.34 O16 Sb2.9'
_chemical_name_mineral           Bahianite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.94
_cell_angle_gamma                90
_cell_length_a                   9.406
_cell_length_b                   11.541
_cell_length_c                   4.410
_cell_volume                     478.662
_exptl_crystal_density_diffrn    5.249
_cod_original_formula_sum        'Sb2.9 Fe.34 Al4.76 O16'
_cod_database_code               9009247
_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            R060433.rod
_rod_data_source.block           3500000
_rod_database.code               1000644
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 9009247 COD http://www.crystallography.net/cod/9009247.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
134.4781 0.0000000E+00
134.9602 0.1608200
135.4423 5.4775000E-02
135.9244 0.1292380
136.4065 0.4381450
136.8886 0.7133790
137.3708 0.9411430
137.8529 1.090191
138.3350 1.027416
138.8171 0.9758950
139.2992 0.9027630
139.7813 0.8794940
140.2635 1.016525
140.7456 1.382683
141.2277 1.979221
141.7098 2.789185
142.1919 3.858356
142.6740 5.040081
143.1561 6.298618
143.6383 7.611904
144.1204 8.945663
144.6025 10.27921
145.0846 11.61402
145.5667 13.01310
146.0488 14.61564
146.5310 16.16146
147.0131 17.39507
147.4952 18.27878
147.9773 18.83614
148.4594 18.92274
148.9415 18.62528
149.4237 18.37757
149.9058 18.30589
150.3879 18.40221
150.8700 18.66561
151.3521 19.18606
151.8342 19.76621
152.3164 20.19120
152.7985 20.48684
153.2806 21.01547
153.7627 22.12356
154.2448 23.65468
154.7269 25.52983
155.2091 27.89642
155.6912 30.16083
156.1733 31.62307
156.6554 32.45705
157.1375 33.22132
157.6196 33.99222
158.1018 34.62382
158.5839 35.72611
159.0660 37.24508
159.5481 39.22190
160.0302 41.81181
160.5123 45.00787
160.9945 48.55156
161.4766 51.94886
161.9587 54.96025
162.4408 58.25080
162.9229 62.66478
163.4050 66.94029
163.8871 70.17799
164.3693 72.03639
164.8514 72.28329
165.3335 70.19609
165.8156 64.83147
166.2977 58.46887
166.7798 50.42831
167.2620 41.65100
167.7441 33.51775
168.2262 26.59288
168.7083 20.75251
169.1904 15.78835
169.6725 11.68396
170.1547 8.176579
170.6368 5.184952
171.1189 2.722321
171.6010 0.8766750
172.0831 0.1748700
172.5652 0.6246640
173.0474 1.016041
173.5295 1.327927
174.0116 1.621616
174.4937 1.983505
174.9758 2.413849
175.4579 2.734016
175.9401 2.952152
176.4222 2.954281
176.9043 2.562004
177.3864 1.648865
177.8685 0.5525890
178.3506 0.2726860
178.8328 0.7262460
179.3149 1.277817
179.7970 2.143780
180.2791 3.151638
180.7612 4.185211
181.2433 5.223103
181.7255 6.213139
182.2076 7.045200
182.6897 7.676872
183.1718 8.201534
183.6539 8.571045
184.1360 8.891174
184.6181 9.295944
185.1003 9.861374
185.5824 10.50395
186.0645 10.90424
186.5466 10.71305
187.0287 10.70198
187.5108 10.89976
187.9930 11.34460
188.4751 12.16556
188.9572 13.45756
189.4393 15.07499
189.9214 16.17478
190.4035 15.96765
190.8857 16.11710
191.3678 16.92916
191.8499 18.30525
192.3320 20.13290
192.8141 22.35954
193.2962 24.91335
193.7784 27.21672
194.2605 28.81287
194.7426 30.68906
195.2247 33.28554
195.7068 36.45825
196.1889 39.83336
196.6711 43.26942
197.1532 46.68433
197.6353 49.74669
198.1174 53.12174
198.5995 55.61998
199.0816 56.32812
199.5638 55.42186
200.0459 54.14635
200.5280 53.50786
201.0101 52.82785
201.4922 50.52536
201.9743 46.08270
202.4565 40.45471
202.9386 33.90487
203.4207 26.37506
203.9028 19.47731
204.3849 14.07116
204.8670 9.938889
205.3492 6.889713
205.8313 5.085167
206.3134 4.109821
206.7955 3.545620
207.2776 3.418606
207.7597 3.588512
208.2419 4.289192
208.7240 5.146378
209.2061 5.758968
209.6882 5.925793
210.1703 5.945587
210.6524 6.323219
211.1346 7.109718
211.6167 8.134472
212.0988 9.429016
212.5809 10.86108
213.0630 12.31118
213.5451 13.71629
214.0273 15.14787
214.5094 16.78836
214.9915 18.83219
215.4736 20.73287
215.9557 22.32530
216.4378 23.77778
216.9200 25.29107
217.4021 26.94936
217.8842 28.66129
218.3663 30.15727
218.8484 31.42802
219.3305 32.44636
219.8127 33.62165
220.2948 34.41948
220.7769 34.25890
221.2590 32.87531
221.7411 30.48320
222.2232 27.69899
222.7054 23.87975
223.1875 20.43025
223.6696 17.50776
224.1517 14.96064
224.6338 12.61906
225.1159 10.39694
225.5980 8.348576
226.0802 6.639889
226.5623 5.408871
227.0444 4.379959
227.5265 3.537327
228.0086 2.887688
228.4907 2.504452
228.9729 2.429398
229.4550 2.528008
229.9371 2.407368
230.4192 1.900387
230.9013 1.498314
231.3834 1.181099
231.8656 1.042286
232.3477 1.266151
232.8298 1.951027
233.3119 2.906353
233.7940 3.690372
234.2761 4.115250
234.7583 4.901379
235.2404 6.196598
235.7225 8.016560
236.2046 10.34074
236.6867 13.13265
237.1688 16.41581
237.6510 20.46484
238.1331 25.35206
238.6152 30.16216
239.0973 34.97167
239.5794 39.47389
240.0615 42.90897
240.5437 44.94926
241.0258 46.13198
241.5079 47.05606
241.9900 47.73246
242.4721 48.39372
242.9542 49.01180
243.4364 49.68262
243.9185 50.66669
244.4006 52.05740
244.8827 53.70841
245.3648 55.41626
245.8469 57.18896
246.3290 59.20298
246.8112 61.60308
247.2933 64.30643
247.7754 67.11595
248.2575 69.97569
248.7396 72.99857
249.2217 76.22129
249.7039 79.63689
250.1860 83.23701
250.6681 86.64533
251.1502 90.15904
251.6323 94.92426
252.1144 100.9447
252.5966 108.4166
253.0787 116.9870
253.5608 126.7898
254.0429 138.3865
254.5250 152.9216
255.0071 169.4814
255.4893 185.1526
255.9714 201.7441
256.4535 213.9262
256.9356 221.6300
257.4177 223.9919
257.8998 219.2681
258.3820 205.4847
258.8641 184.3861
259.3462 161.4982
259.8283 134.3650
260.3104 109.6760
260.7925 88.47768
261.2747 70.64491
261.7568 56.25571
262.2389 45.48305
262.7210 37.71958
263.2031 31.15775
263.6852 26.07079
264.1674 21.87236
264.6495 18.56553
265.1316 15.84911
265.6137 13.45306
266.0958 11.26551
266.5779 9.306007
267.0601 7.628433
267.5422 6.244358
268.0243 5.182495
268.5064 4.532505
268.9885 4.096432
269.4706 3.709538
269.9528 3.327942
270.4349 3.021557
270.9170 2.894207
271.3991 2.984085
271.8812 3.204391
272.3633 3.425285
272.8455 3.828400
273.3276 4.586330
273.8097 5.722130
274.2918 7.077511
274.7739 8.417183
275.2560 9.685574
275.7382 11.03104
276.2202 12.67279
276.7024 14.20679
277.1845 15.38610
277.6666 16.17876
278.1487 16.69489
278.6308 17.02375
279.1129 17.08849
279.5951 17.40816
280.0772 18.04395
280.5593 18.83488
281.0414 19.76182
281.5235 20.78275
282.0056 21.80093
282.4878 22.70495
282.9699 23.45898
283.4520 24.40917
283.9341 25.72163
284.4162 27.04338
284.8983 28.03091
285.3805 28.87876
285.8626 30.16679
286.3447 32.44086
286.8268 35.66340
287.3089 37.99154
287.7910 38.27098
288.2732 38.96216
288.7553 40.82275
289.2374 43.60343
289.7195 46.77896
290.2016 50.06002
290.6837 53.41540
291.1659 56.76863
291.6480 60.85357
292.1301 64.05708
292.6122 66.22838
293.0943 67.32457
293.5764 67.36419
294.0586 66.36190
294.5407 63.61510
295.0228 60.58227
295.5049 54.57302
295.9870 48.08050
296.4691 40.40703
296.9513 32.60826
297.4334 25.67630
297.9155 19.97886
298.3976 15.41344
298.8797 11.87004
299.3618 9.848457
299.8440 8.078300
300.3261 6.629311
300.8082 5.392944
301.2903 4.204594
301.7724 3.066883
302.2545 2.198685
302.7367 1.898487
303.2188 2.384678
303.7009 2.671665
304.1830 2.707367
304.6651 2.609444
305.1472 2.331417
305.6294 1.934811
306.1115 1.661850
306.5936 1.748291
307.0757 2.224632
307.5578 2.576851
308.0399 2.519650
308.5221 2.634731
309.0042 3.281216
309.4863 4.322971
309.9684 5.393227
310.4505 6.271633
310.9326 6.969460
311.4148 7.493801
311.8969 7.605701
312.3790 7.849537
312.8611 8.380512
313.3432 9.123180
313.8253 9.926117
314.3075 10.70851
314.7896 11.57597
315.2717 12.83032
315.7538 15.03729
316.2359 16.81770
316.7180 17.95212
317.2001 18.65683
317.6823 19.14302
318.1644 19.47733
318.6465 19.63231
319.1286 19.55665
319.6107 19.14771
320.0928 18.71949
320.5750 18.54322
321.0571 18.16282
321.5392 17.09879
322.0213 15.36895
322.5034 13.48812
322.9855 12.02066
323.4677 11.06895
323.9498 9.624336
324.4319 7.102245
324.9140 4.701569
325.3961 3.004345
325.8782 1.949440
326.3604 1.191219
326.8425 0.5077210
327.3246 9.7182997E-02
327.8067 0.5888790
328.2888 0.8785780
328.7709 1.173595
329.2531 1.542892
329.7352 1.947895
330.2173 2.343178
330.6994 2.711998
331.1815 3.019859
331.6636 3.172649
332.1458 3.126354
332.6279 2.961742
333.1100 2.606537
333.5921 2.171528
334.0742 1.785759
334.5563 1.480965
335.0385 1.149532
335.5206 0.6217190
336.0027 0.2529300
336.4848 0.9365270
336.9669 1.426289
337.4490 1.758404
337.9312 1.880890
338.4133 1.840721
338.8954 1.786488
339.3775 1.829906
339.8596 1.952633
340.3417 2.424099
340.8239 3.752392
341.3060 4.855717
341.7881 5.214947
342.2702 5.060753
342.7523 4.855816
343.2344 4.866962
343.7166 5.101940
344.1987 5.602753
344.6808 6.724148
345.1629 7.722691
345.6450 8.391670
346.1271 8.956108
346.6093 9.649048
347.0914 10.55443
347.5735 11.64218
348.0556 12.84219
348.5377 14.19291
349.0198 15.61189
349.5020 17.06966
349.9841 18.60568
350.4662 20.42954
350.9483 22.44139
351.4304 24.18064
351.9125 25.13026
352.3947 25.21997
352.8768 24.96967
353.3589 24.58661
353.8410 23.66798
354.3231 21.77036
354.8052 19.22326
355.2874 16.67534
355.7695 14.57803
356.2516 12.84525
356.7337 10.90185
357.2158 8.170456
357.6979 6.055767
358.1800 5.117157
358.6621 4.744312
359.1443 4.295780
359.6264 3.521675
360.1085 2.592274
360.5906 1.778675
361.0727 1.042919
361.5548 0.5363390
362.0370 0.3412780
362.5191 0.3101500
363.0012 0.4074750
363.4833 0.6039280
363.9654 0.8209920
364.4475 0.9698410
364.9297 1.043289
365.4118 1.168293
365.8939 1.351444
366.3760 1.585838
366.8581 1.754974
367.3402 1.973465
367.8224 2.492119
368.3045 3.534084
368.7866 4.907722
369.2687 6.048065
369.7508 6.875793
370.2329 7.631611
370.7151 8.372807
371.1972 9.102436
371.6793 9.812702
372.1614 10.48626
372.6435 11.21056
373.1256 12.20298
373.6078 13.51832
374.0899 14.47243
374.5720 14.65638
375.0541 14.63386
375.5362 14.81476
376.0183 15.20924
376.5005 15.64990
376.9826 16.02860
377.4647 16.36121
377.9468 16.69729
378.4289 17.00876
378.9110 17.39894
379.3932 17.96861
379.8753 18.66258
380.3574 19.37408
380.8395 19.98198
381.3216 20.65941
381.8037 21.62745
382.2859 22.89398
382.7680 24.26050
383.2501 25.68448
383.7322 27.15205
384.2143 28.64101
384.6964 30.14038
385.1786 31.64097
385.6607 33.21902
386.1428 34.78535
386.6249 36.04715
387.1070 36.85896
387.5891 37.50613
388.0713 38.50187
388.5534 39.81432
389.0355 40.64584
389.5176 40.26407
389.9997 39.71149
390.4818 40.05145
390.9640 41.33132
391.4461 42.95113
391.9282 44.49990
392.4103 46.05706
392.8924 48.01693
393.3745 50.59217
393.8567 53.34772
394.3388 56.15612
394.8209 58.95977
395.3030 61.63131
395.7851 64.14620
396.2672 66.52304
396.7494 68.79781
397.2315 70.80729
397.7136 73.10722
398.1957 75.95809
398.6778 78.96995
399.1599 81.77593
399.6420 84.37564
400.1241 87.06837
400.6063 90.12053
401.0884 93.55363
401.5705 97.03745
402.0526 100.4352
402.5347 104.0283
403.0168 108.1429
403.4990 112.4694
403.9811 116.3822
404.4632 119.5560
404.9453 122.4388
405.4274 126.1462
405.9095 131.3362
406.3917 136.2331
406.8738 140.6597
407.3559 144.8782
407.8380 149.2198
408.3201 153.6378
408.8022 157.7615
409.2844 161.3951
409.7665 164.5697
410.2486 166.4158
410.7307 166.8987
411.2128 165.8979
411.6949 163.5096
412.1771 159.6028
412.6592 153.8795
413.1413 146.0997
413.6234 136.7423
414.1055 126.6763
414.5876 115.6017
415.0698 104.5812
415.5519 93.34604
416.0340 82.64691
416.5161 72.98464
416.9982 64.38745
417.4803 56.87478
417.9625 50.63632
418.4446 45.55625
418.9267 40.65377
419.4088 35.72656
419.8909 31.29731
420.3730 27.83894
420.8552 25.10036
421.3373 22.67668
421.8194 20.59804
422.3015 18.59717
422.7836 16.25246
423.2657 13.57714
423.7479 11.14779
424.2300 9.146252
424.7121 7.585018
425.1942 6.452740
425.6763 5.816402
426.1584 5.253029
426.6406 4.591591
427.1227 3.883694
427.6048 3.193783
428.0869 2.521973
428.5690 1.956532
429.0511 1.627838
429.5333 1.533028
430.0154 1.283688
430.4975 0.6587450
430.9796 8.5423000E-02
431.4617 0.1199040
431.9438 7.6897003E-02
432.4260 0.1148340
432.9081 0.3950390
433.3902 0.8189890
433.8723 1.156334
434.3544 1.375893
434.8365 1.553154
435.3187 1.633072
435.8008 1.710239
436.2829 1.888004
436.7650 2.160942
437.2471 2.433338
437.7292 2.629879
438.2114 2.753597
438.6935 2.696228
439.1756 2.250378
439.6577 1.850101
440.1398 1.556496
440.6219 1.378284
441.1040 1.352257
441.5862 1.492893
442.0683 1.699799
442.5504 1.804283
443.0325 1.813774
443.5146 1.693920
443.9967 1.481773
444.4789 1.103165
444.9610 0.3932380
445.4431 0.5523610
445.9252 1.418797
446.4073 1.931358
446.8894 2.185616
447.3716 2.561722
447.8537 3.120598
448.3358 3.647209
448.8179 4.062458
449.3000 4.390755
449.7821 4.647530
450.2643 4.833054
450.7464 4.959240
451.2285 4.914993
451.7106 4.778618
452.1927 4.989773
452.6748 5.734531
453.1570 6.636101
453.6391 7.356087
454.1212 7.920525
454.6033 8.392380
455.0854 8.610954
455.5675 8.868771
456.0497 9.485676
456.5318 10.41413
457.0139 11.33480
457.4960 12.05602
457.9781 12.70348
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