#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 14:01:25 +0300 (Thu, 26 Apr 2018) $
#$Revision: 607 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000146.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_1000146
loop_
_publ_author_name
'Arakcheeva, A. V.'
'Pushcharovskii, D. Y.'
'Rastsvetaeva, R. K.'
'Kashaev, A. A.'
'Nadezhina, T. N.'
_publ_section_title
;
 Crystal structure of nigerite-6H
;
_journal_name_full               Kristallografiya
_journal_page_first              639
_journal_page_last               644
_journal_volume                  40
_journal_year                    1995
_chemical_compound_source        'Eastern Siberia, Irkutsk, Russia'
_chemical_formula_sum            'Al8.435 Fe0.83 H O15 Sn Zn0.36'
_chemical_name_mineral           Ferronigerite-2N1S
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   5.717
_cell_length_b                   5.717
_cell_length_c                   13.80
_cell_volume                     390.612
_exptl_crystal_density_diffrn    5.588
_cod_original_formula_sum        'Al8.435 Fe.83 Zn.36 Sn O15 H'
_cod_database_code               9015437
_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            R120083.rod
_rod_data_source.block           3500000
_rod_database.code               1000146
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 9015437 COD http://www.crystallography.net/cod/9015437.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
121.4948 0.0000000E+00
121.9769 3.874634
122.4590 10.81580
122.9411 18.13782
123.4232 25.43848
123.9053 32.82056
124.3875 39.37512
124.8696 45.67529
125.3517 54.12024
125.8338 65.88464
126.3159 76.53809
126.7980 84.03503
127.2802 88.43530
127.7623 89.90906
128.2444 90.28040
128.7265 89.41455
129.2086 85.54651
129.6907 73.49365
130.1729 60.22058
130.6550 47.66809
131.1371 36.25586
131.6192 26.29993
132.1013 18.37830
132.5834 13.15808
133.0656 8.838501
133.5477 5.408081
134.0298 2.664917
134.5119 0.4969480
134.9940 1.136108
135.4761 2.268311
135.9583 2.948242
136.4404 3.286133
136.9225 2.088745
137.4046 1.173584
137.8867 4.028076
138.3688 5.985718
138.8510 7.615112
139.3331 9.194092
139.8152 10.06665
140.2973 10.08191
140.7794 9.825195
141.2615 8.950195
141.7437 7.678711
142.2258 7.112427
142.7079 8.275391
143.1900 10.30017
143.6721 11.28271
144.1542 10.59155
144.6364 9.507202
145.1185 9.411499
145.6006 10.48901
146.0827 11.41504
146.5648 11.61133
147.0469 11.26282
147.5291 10.40613
148.0112 8.910645
148.4933 7.072998
148.9754 5.570435
149.4575 4.568726
149.9396 3.650146
150.4218 2.969849
150.9039 2.218140
151.3860 0.8447270
151.8681 1.677002
152.3502 5.086304
152.8323 7.003296
153.3145 6.055298
153.7966 4.787720
154.2787 3.172852
154.7608 1.612183
155.2429 0.7730710
155.7250 1.289795
156.2072 3.315796
156.6893 4.428833
157.1714 4.666382
157.6535 4.205688
158.1356 2.567627
158.6177 7.9956003E-02
159.0999 2.086304
159.5820 2.728027
160.0641 1.509521
160.5462 1.119385
161.0283 1.371582
161.5104 2.504517
161.9926 5.186768
162.4747 9.461670
162.9568 13.82410
163.4389 16.48096
163.9210 17.53711
164.4031 18.72876
164.8853 20.94971
165.3674 23.30005
165.8495 24.29089
166.3316 23.45618
166.8137 21.95715
167.2958 20.75549
167.7780 19.80115
168.2601 18.96765
168.7422 18.29614
169.2243 17.72754
169.7064 16.97034
170.1885 15.74023
170.6707 14.66248
171.1528 13.97778
171.6349 13.71606
172.1170 13.94336
172.5991 14.97681
173.0812 16.87708
173.5634 18.27014
174.0455 17.84802
174.5276 17.91565
175.0097 19.57825
175.4918 22.76208
175.9739 26.64990
176.4561 30.45496
176.9382 34.30029
177.4203 37.70142
177.9024 39.42859
178.3845 41.68689
178.8666 46.12720
179.3488 52.56433
179.8309 59.57397
180.3130 64.91125
180.7951 67.55872
181.2772 70.67346
181.7593 73.70276
182.2415 77.44678
182.7236 82.91589
183.2057 90.20691
183.6878 98.04541
184.1699 104.4470
184.6520 108.2042
185.1342 112.9001
185.6163 119.1661
186.0984 126.1438
186.5805 132.7822
187.0626 138.7391
187.5447 144.7782
188.0269 152.4757
188.5090 162.3542
188.9911 171.5220
189.4732 178.0183
189.9553 183.5753
190.4374 191.4773
190.9196 203.3610
191.4017 216.5276
191.8838 226.8751
192.3659 234.1132
192.8480 241.7532
193.3301 251.8340
193.8123 263.7583
194.2944 275.4352
194.7765 286.6055
195.2586 297.0887
195.7407 306.5197
196.2228 314.7855
196.7050 323.0735
197.1871 332.6063
197.6692 343.2944
198.1513 352.9884
198.6334 360.4539
199.1155 367.4469
199.5977 375.2117
200.0798 383.8208
200.5619 392.4844
201.0440 400.3694
201.5261 407.3789
202.0082 414.6404
202.4904 423.0963
202.9725 431.3085
203.4546 438.6426
203.9367 444.9938
204.4188 450.5822
204.9009 455.5894
205.3831 459.9327
205.8652 463.8879
206.3473 467.8650
206.8294 471.2129
207.3115 473.3016
207.7936 474.1359
208.2758 474.3749
208.7579 474.9307
209.2400 476.0729
209.7221 476.8685
210.2042 477.0471
210.6863 477.0140
211.1685 477.1699
211.6506 477.5719
212.1327 478.0806
212.6148 478.4758
213.0969 478.5969
213.5790 478.7823
214.0612 479.4791
214.5433 479.9116
215.0254 479.1938
215.5075 477.2208
215.9896 475.0203
216.4717 474.0364
216.9539 474.8921
217.4360 475.4150
217.9181 476.0304
218.4002 476.0729
218.8823 474.4767
219.3644 470.9734
219.8466 467.0684
220.3287 464.9484
220.8108 464.9764
221.2929 464.6178
221.7750 463.4531
222.2571 461.7653
222.7393 459.9395
223.2214 458.0867
223.7035 455.9526
224.1856 453.2325
224.6677 450.0065
225.1498 446.1884
225.6320 441.5120
226.1141 436.2925
226.5962 431.0887
227.0783 426.0581
227.5604 420.8251
228.0425 414.7026
228.5247 407.9580
229.0068 401.4830
229.4889 395.9138
229.9710 390.8873
230.4531 385.5425
230.9352 379.7712
231.4174 373.7002
231.8995 367.3344
232.3816 360.7911
232.8637 354.3730
233.3458 348.6505
233.8279 343.1727
234.3101 336.1650
234.7922 326.6969
235.2743 317.7440
235.7564 310.7970
236.2385 305.1683
236.7206 299.8566
237.2028 294.8917
237.6849 290.0891
238.1670 284.1139
238.6491 276.6487
239.1312 268.0580
239.6133 257.9594
240.0955 247.0950
240.5776 236.4213
241.0597 226.2905
241.5418 216.7748
242.0239 208.7878
242.5060 203.6844
242.9882 198.5636
243.4703 192.0820
243.9524 184.9657
244.4345 178.3528
244.9166 173.0061
245.3987 168.7708
245.8809 164.8713
246.3630 161.1569
246.8451 157.6672
247.3272 154.0745
247.8093 150.9108
248.2914 149.0935
248.7736 149.2321
249.2557 150.6499
249.7378 150.4944
250.2199 146.5453
250.7020 143.7273
251.1841 143.0127
251.6663 143.6788
252.1484 144.9243
252.6305 146.3623
253.1126 147.9701
253.5947 149.7312
254.0768 152.0900
254.5590 154.0422
255.0411 154.9348
255.5232 155.6394
256.0053 157.1686
256.4874 159.9435
256.9695 163.5729
257.4517 167.0990
257.9338 168.8829
258.4159 172.7070
258.8980 180.3500
259.3801 189.2885
259.8622 196.5962
260.3444 201.2996
260.8265 205.1572
261.3086 211.5396
261.7907 223.3140
262.2728 233.2050
262.7549 240.3981
263.2371 246.0548
263.7192 251.2687
264.2013 256.3523
264.6834 260.8881
265.1655 264.1913
265.6476 265.6741
266.1298 267.1776
266.6119 269.7297
267.0940 271.7875
267.5761 271.9326
268.0582 269.8942
268.5403 266.2932
269.0225 261.8641
269.5046 256.6182
269.9867 249.7772
270.4688 240.3553
270.9509 229.9598
271.4330 220.1677
271.9152 211.1359
272.3973 201.5116
272.8794 189.8528
273.3615 175.9257
273.8436 162.6611
274.3257 150.3508
274.8079 138.4539
275.2900 126.5923
275.7721 114.7219
276.2542 103.2810
276.7363 92.32507
277.2184 82.15771
277.7006 73.29846
278.1827 65.94641
278.6648 59.81421
279.1469 55.34082
279.6290 52.30237
280.1111 48.99158
280.5933 44.28723
281.0754 38.54858
281.5575 33.19470
282.0396 28.36816
282.5217 23.76526
283.0038 18.65967
283.4860 13.37537
283.9681 9.710571
284.4502 9.058105
284.9323 10.10474
285.4144 9.937744
285.8965 8.190796
286.3787 6.210938
286.8608 4.494995
287.3429 3.096802
287.8250 2.264893
288.3071 2.276245
288.7892 2.636963
289.2714 2.549805
289.7535 1.938721
290.2356 1.509766
290.7177 2.210449
291.1998 3.362915
291.6819 2.834717
292.1641 0.5866700
292.6462 4.334473
293.1283 5.097534
293.6104 3.273926
294.0925 2.057007
294.5746 3.346558
295.0568 5.990234
295.5389 7.678711
296.0210 8.003662
296.5031 7.790527
296.9852 7.800781
297.4673 7.870117
297.9495 7.418335
298.4316 5.560181
298.9137 3.341919
299.3958 2.549194
299.8779 3.500854
300.3600 4.499023
300.8422 4.011841
301.3243 2.861572
301.8064 2.575928
302.2885 4.376709
302.7706 6.307983
303.2527 5.879639
303.7349 2.937744
304.2170 0.2385250
304.6991 2.985718
305.1812 5.126953
305.6633 6.296753
306.1454 6.111450
306.6276 5.771973
307.1097 6.606323
307.5918 8.514526
308.0739 9.693970
308.5560 9.013428
309.0381 7.798462
309.5203 7.568237
310.0024 8.423096
310.4845 9.576172
310.9666 10.43054
311.4487 11.09814
311.9308 12.17712
312.4130 13.94653
312.8951 15.90869
313.3772 17.34033
313.8593 18.37854
314.3414 19.97327
314.8235 23.17468
315.3057 27.25867
315.7878 30.38721
316.2699 32.26233
316.7520 33.48608
317.2341 34.13452
317.7162 34.47327
318.1984 35.09888
318.6805 36.22083
319.1626 37.75769
319.6447 39.77295
320.1268 42.43079
320.6089 44.76318
321.0911 45.66125
321.5732 46.06299
322.0553 47.32495
322.5374 50.03674
323.0195 53.24634
323.5016 55.94360
323.9838 58.08960
324.4659 60.07861
324.9480 62.10925
325.4301 64.04285
325.9122 65.73523
326.3943 67.23059
326.8765 68.59009
327.3586 69.36292
327.8407 69.77783
328.3228 71.38977
328.8049 75.10181
329.2870 79.23914
329.7692 82.47595
330.2513 84.85889
330.7334 86.03625
331.2155 84.90649
331.6976 82.34338
332.1797 80.82141
332.6619 81.03577
333.1440 81.45557
333.6261 80.33044
334.1082 78.26318
334.5903 76.87512
335.0724 76.84888
335.5546 77.71497
336.0367 79.35486
336.5188 81.97205
337.0009 83.80969
337.4830 83.41077
337.9651 81.62280
338.4473 80.10938
338.9294 79.25232
339.4115 78.32397
339.8936 76.65405
340.3757 74.33191
340.8578 71.94702
341.3400 69.38086
341.8221 67.16077
342.3042 66.08777
342.7863 66.33264
343.2684 66.64697
343.7505 66.66870
344.2327 66.28589
344.7148 65.12744
345.1969 62.94080
345.6790 60.41553
346.1611 58.14587
346.6432 56.11914
347.1254 54.68213
347.6075 54.31567
348.0896 54.38635
348.5717 54.22583
349.0538 53.78540
349.5359 53.03784
350.0181 51.70312
350.5002 49.81616
350.9823 48.19336
351.4644 46.82654
351.9465 46.04150
352.4286 45.95020
352.9108 46.42188
353.3929 47.49780
353.8750 49.66040
354.3571 52.11133
354.8392 52.75525
355.3214 51.14038
355.8035 49.11804
356.2856 47.31506
356.7677 45.67249
357.2498 43.95361
357.7319 42.00952
358.2141 39.85425
358.6962 37.39648
359.1783 34.47266
359.6604 32.55212
360.1425 32.52380
360.6246 32.91516
361.1068 32.60425
361.5889 31.61487
362.0710 30.28040
362.5531 28.60974
363.0352 26.58276
363.5173 25.46497
363.9995 26.25403
364.4816 26.81970
364.9637 25.68433
365.4458 23.51660
365.9279 22.05725
366.4100 22.24292
366.8922 23.60583
367.3743 24.69739
367.8564 25.49597
368.3385 26.11292
368.8206 26.81848
369.3027 27.22510
369.7849 26.70325
370.2670 25.11072
370.7491 23.13232
371.2312 21.75806
371.7133 21.38220
372.1954 20.39856
372.6776 18.15491
373.1597 15.90417
373.6418 14.64343
374.1239 14.18530
374.6060 13.46436
375.0881 11.53894
375.5703 8.474243
376.0524 6.313965
376.5345 5.812256
377.0166 5.330200
377.4987 4.391724
377.9808 3.278931
378.4630 2.481812
378.9451 2.226929
379.4272 2.250854
379.9093 1.873169
380.3914 0.5118410
380.8735 0.2463380
381.3557 0.1512450
381.8378 0.7507320
382.3199 1.031738
382.8020 0.8242190
383.2841 1.6235000E-02
383.7662 1.667603
384.2484 4.440552
384.7305 6.651123
385.2126 8.275635
385.6947 9.332153
386.1768 9.452637
386.6589 9.019409
387.1411 8.818848
387.6232 9.425171
388.1053 10.44519
388.5874 10.31335
389.0695 8.057495
389.5516 6.500610
390.0338 6.991943
390.5159 7.981567
390.9980 7.995728
391.4801 6.624390
391.9622 4.720703
392.4443 3.080078
392.9265 1.636597
393.4086 1.103760
393.8907 2.232056
394.3728 3.721191
394.8549 4.998169
395.3370 6.006714
395.8192 6.706787
396.3013 7.074707
396.7834 7.110596
397.2655 6.917236
397.7476 6.712402
398.2297 5.709106
398.7119 2.697632
399.1940 1.115967
399.6761 4.132446
400.1582 5.740112
400.6403 6.911621
401.1224 8.931274
401.6046 11.70813
402.0867 13.30225
402.5688 12.57178
403.0509 11.00391
403.5330 10.27295
404.0151 10.36572
404.4973 11.00439
404.9794 12.50793
405.4615 14.35425
405.9436 15.60803
406.4257 16.11975
406.9078 16.33862
407.3900 16.61877
407.8721 16.90063
408.3542 16.91943
408.8363 15.71240
409.3184 15.09216
409.8005 16.70947
410.2827 20.00769
410.7648 23.01648
411.2469 24.84656
411.7290 25.94702
412.2111 27.29993
412.6932 29.02185
413.1754 30.64648
413.6575 31.68750
414.1396 32.79846
414.6217 34.91968
415.1038 38.11328
415.5859 41.39270
416.0681 43.89465
416.5502 45.62573
417.0323 46.08105
417.5144 43.50000
417.9965 41.67712
418.4786 42.61865
418.9608 45.39368
419.4429 48.08960
419.9250 49.71228
420.4071 50.70361
420.8892 52.30798
421.3713 55.22461
421.8535 57.70227
422.3356 59.58813
422.8177 61.14392
423.2998 62.48621
423.7819 63.68225
424.2640 64.83728
424.7462 66.16272
425.2283 67.73022
425.7104 68.44702
426.1925 66.67004
426.6746 65.83508
427.1567 67.54211
427.6389 70.68054
428.1210 73.46509
428.6031 75.00671
429.0852 75.93640
429.5673 77.58240
430.0494 80.20972
430.5316 82.61011
431.0137 83.53772
431.4958 84.82288
431.9779 88.33313
432.4600 93.92590
432.9421 98.79993
433.4243 100.0144
433.9064 98.56934
434.3885 98.87256
434.8706 101.4873
435.3527 105.0358
435.8348 109.1927
436.3170 113.5822
436.7991 117.6152
437.2812 121.0330
437.7633 124.1864
438.2454 127.0183
438.7275 129.6956
439.2097 133.3367
439.6918 138.5200
440.1739 144.4882
440.6560 149.8955
441.1381 154.5688
441.6202 160.2310
442.1024 167.8175
442.5845 176.3251
443.0666 184.3099
443.5487 191.7675
444.0308 200.2183
444.5129 211.1238
444.9951 224.0861
445.4772 235.7499
445.9593 244.3250
446.4414 253.8127
446.9235 265.6229
447.4056 279.1422
447.8878 293.8507
448.3699 309.5320
448.8520 325.1213
449.3341 338.9622
449.8162 350.0891
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