#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 13:45:51 +0300 (Thu, 26 Apr 2018) $
#$Revision: 570 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000114.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_1000114
loop_
_publ_author_name
'Kolitsch, U.'
'Giester, G.'
_publ_section_title
;
 The crystal structure of namibite, Cu(BiO)2VO4(OH), and a revision of its
 symmetry
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1298
_journal_page_last               1301
_journal_volume                  85
_journal_year                    2000
_chemical_compound_source        R100182
_chemical_formula_sum            'Bi2 Cu H O7 V'
_chemical_name_mineral           Namibite
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                90.10
_cell_angle_beta                 108.73
_cell_angle_gamma                107.47
_cell_length_a                   6.210
_cell_length_b                   7.398
_cell_length_c                   7.471
_cell_volume                     308.224
_exptl_crystal_density_diffrn    6.955
_cod_original_formula_sum        'Bi2 Cu V O7 H'
_cod_database_code               9002427
_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            R100182.rod
_rod_data_source.block           3500000
_rod_database.code               1000114
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 9002427 COD http://www.crystallography.net/cod/9002427.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
98.80145 0.0000000E+00
99.28356 0.8490910
99.76568 1.396896
100.2478 1.299957
100.7299 8.4197998E-02
101.2120 0.2895970
101.6941 0.8760830
102.1763 2.117325
102.6584 3.361496
103.1405 4.609039
103.6226 5.758118
104.1047 6.660645
104.5868 7.512558
105.0690 9.568512
105.5511 13.99811
106.0332 18.20564
106.5153 20.72714
106.9974 21.71201
107.4795 22.65646
107.9617 24.81862
108.4438 27.81386
108.9259 30.24811
109.4080 31.70016
109.8901 32.63632
110.3722 33.77928
110.8544 35.58878
111.3365 36.45209
111.8186 35.04991
112.3007 32.06877
112.7828 28.60208
113.2649 25.09010
113.7471 21.53830
114.2292 18.27831
114.7113 15.29579
115.1934 12.66400
115.6755 10.33426
116.1576 8.336487
116.6397 6.804214
117.1219 5.906189
117.6040 5.837189
118.0861 5.832825
118.5682 6.121124
119.0503 6.292465
119.5324 5.971771
120.0146 5.137848
120.4967 4.165436
120.9788 3.696548
121.4609 4.228958
121.9430 4.574631
122.4251 4.398727
122.9073 4.140244
123.3894 4.309036
123.8715 5.103226
124.3536 6.407135
124.8357 8.015610
125.3178 10.02095
125.8000 12.03413
126.2821 13.95235
126.7642 15.77144
127.2463 17.44438
127.7284 18.91364
128.2105 20.25157
128.6927 21.61444
129.1748 22.90445
129.6569 24.41481
130.1390 26.65669
130.6211 29.03830
131.1032 31.68036
131.5854 35.21614
132.0675 39.17537
132.5496 42.27374
133.0317 44.67867
133.5138 46.90739
133.9959 49.36328
134.4781 51.80821
134.9602 53.88181
135.4423 55.51804
135.9244 56.71232
136.4065 57.51614
136.8886 58.62344
137.3708 60.17922
137.8529 60.71306
138.3350 58.76740
138.8171 57.30981
139.2992 57.53108
139.7813 58.93312
140.2635 60.18301
140.7456 60.05096
141.2277 58.28479
141.7098 57.34830
142.1919 57.41730
142.6740 57.94116
143.1561 58.79590
143.6383 59.89478
144.1204 61.05063
144.6025 62.07558
145.0846 62.95006
145.5667 63.68976
146.0488 64.38187
146.5310 64.89184
147.0131 64.97128
147.4952 64.54127
147.9773 64.09680
148.4594 64.45673
148.9415 65.46294
149.4237 66.07932
149.9058 65.71082
150.3879 64.61527
150.8700 63.64059
151.3521 63.26547
151.8342 62.52120
152.3164 60.87080
152.7985 58.31650
153.2806 54.84427
153.7627 50.11757
154.2448 44.09399
154.7269 38.18956
155.2091 32.23597
155.6912 26.78029
156.1733 22.16972
156.6554 18.60348
157.1375 15.66309
157.6196 13.11655
158.1018 11.02585
158.5839 9.184662
159.0660 7.822945
159.5481 6.513672
160.0302 4.732933
160.5123 2.442513
160.9945 0.2390140
161.4766 0.7450640
161.9587 0.8063130
162.4408 1.647766
162.9229 1.468437
163.4050 0.7698140
163.8871 0.1774520
164.3693 1.261650
164.8514 2.213821
165.3335 2.329018
165.8156 0.6257320
166.2977 0.5415650
166.7798 0.6934970
167.2620 0.2060240
167.7441 0.4513400
168.2262 1.145210
168.7083 1.729713
169.1904 1.691917
169.6725 0.6075820
170.1547 0.2204130
170.6368 7.3546998E-02
171.1189 0.7973860
171.6010 1.583267
172.0831 2.021370
172.5652 2.029068
173.0474 1.529961
173.5295 0.1900100
174.0116 1.020729
174.4937 1.173599
174.9758 0.2716450
175.4579 0.4749370
175.9401 0.4189830
176.4222 1.4732000E-02
176.9043 0.3739780
177.3864 0.5503540
177.8685 0.7043000
178.3506 1.095871
178.8328 1.843391
179.3149 2.410576
179.7970 2.533051
180.2791 2.435616
180.7612 2.252205
181.2433 2.006332
181.7255 1.793961
182.2076 1.860901
182.6897 2.469414
183.1718 2.854294
183.6539 2.701637
184.1360 2.347542
184.6181 2.167084
185.1003 2.352791
185.5824 2.758751
186.0645 2.862007
186.5466 2.307854
187.0287 1.863007
187.5108 1.640854
187.9930 1.580185
188.4751 1.572784
188.9572 1.550499
189.4393 1.564888
189.9214 1.931984
190.4035 3.307526
190.8857 4.313354
191.3678 4.571274
191.8499 4.290131
192.3320 3.756958
192.8141 3.072502
193.2962 2.333046
193.7784 2.349525
194.2605 3.892365
194.7426 5.188637
195.2247 5.459290
195.7068 4.962540
196.1889 4.460030
196.6711 4.391907
197.1532 4.692360
197.6353 4.978622
198.1174 5.472214
198.5995 5.758247
199.0816 5.361137
199.5638 4.407387
200.0459 3.764381
200.5280 4.035889
201.0101 4.996475
201.4922 5.845055
201.9743 6.697571
202.4565 7.292282
202.9386 7.278778
203.4207 6.641891
203.9028 6.018997
204.3849 5.645653
204.8670 5.539520
205.3492 5.810081
205.8313 6.734932
206.3134 7.721207
206.7955 7.867569
207.2776 6.943565
207.7597 6.255959
208.2419 6.710007
208.7240 7.589050
209.2061 8.254311
209.6882 8.504333
210.1703 8.449615
210.6524 8.180161
211.1346 7.493668
211.6167 7.138916
212.0988 7.722702
212.5809 8.558220
213.0630 8.935143
213.5451 8.525780
214.0273 7.699181
214.5094 7.299294
214.9915 7.568687
215.4736 7.852287
215.9557 8.000420
216.4378 8.092384
216.9200 8.227623
217.4021 8.452690
217.8842 8.696915
218.3663 8.764832
218.8484 8.575706
219.3305 8.210052
219.8127 7.676445
220.2948 7.122498
220.7769 6.742104
221.2590 6.619652
221.7411 6.663368
222.2232 6.669388
222.7054 6.601181
223.1875 6.622772
223.6696 7.069984
224.1517 7.610832
224.6338 7.726799
225.1159 7.180527
225.5980 6.301483
226.0802 6.104828
226.5623 7.953369
227.0444 8.917259
227.5265 8.089119
228.0086 6.519432
228.4907 5.546196
228.9729 5.724785
229.4550 6.621384
229.9371 7.150948
230.4192 7.374451
230.9013 7.278664
231.3834 6.484291
231.8656 5.481239
232.3477 5.122719
232.8298 5.807419
233.3119 6.874474
233.7940 6.831978
234.2761 5.248253
234.7583 3.967468
235.2404 3.575745
235.7225 3.752052
236.2046 3.907570
236.6867 3.803131
237.1688 3.728081
237.6510 4.411140
238.1331 6.057106
238.6152 7.158234
239.0973 6.792557
239.5794 5.548210
240.0615 4.713638
240.5437 4.719116
241.0258 5.055878
241.5079 5.026619
241.9900 4.635918
242.4721 4.302422
242.9542 4.189796
243.4364 4.270386
243.9185 4.514442
244.4006 5.016083
244.8827 5.477684
245.3648 5.640762
245.8469 5.531776
246.3290 5.201836
246.8112 4.506889
247.2933 3.595940
247.7754 2.916283
248.2575 2.569611
248.7396 2.417809
249.2217 2.493980
249.7039 2.694893
250.1860 2.649559
250.6681 1.927162
251.1502 0.7572940
251.6323 2.3414999E-02
252.1144 2.8587000E-02
252.5966 6.3773997E-02
253.0787 0.1200710
253.5608 0.4324950
254.0429 0.5172880
254.5250 2.0111000E-02
255.0071 0.9559630
255.4893 1.367676
255.9714 0.9252010
256.4535 0.4679410
256.9356 0.4416730
257.4177 0.6431350
257.8998 0.7349620
258.3820 0.4901050
258.8641 3.0609000E-02
259.3462 0.1967240
259.8283 1.3939000E-02
260.3104 0.1154940
260.7925 0.2243120
261.2747 0.7258300
261.7568 1.015816
262.2389 0.8979490
262.7210 0.4748610
263.2031 3.9369999E-03
263.6852 0.7672120
264.1674 1.167953
264.6495 0.6206820
265.1316 0.1401370
265.6137 0.2242740
266.0958 0.7878190
266.5779 2.370979
267.0601 3.240265
267.5422 2.913712
268.0243 2.696526
268.5064 2.920219
268.9885 3.247696
269.4706 3.356026
269.9528 3.139694
270.4349 2.773621
270.9170 2.544373
271.3991 2.300629
271.8812 2.533653
272.3633 3.740318
272.8455 5.059982
273.3276 5.842903
273.8097 5.932861
274.2918 5.595505
274.7739 5.167465
275.2560 4.419609
275.7382 4.101387
276.2202 4.348785
276.7024 4.821800
277.1845 5.303543
277.6666 5.767845
278.1487 6.342438
278.6308 7.236122
279.1129 8.661636
279.5951 9.649254
280.0772 9.908615
280.5593 10.06900
281.0414 10.47982
281.5235 11.12803
282.0056 11.77110
282.4878 12.15775
282.9699 12.23153
283.4520 12.45273
283.9341 12.98930
284.4162 13.50117
284.8983 13.84506
285.3805 14.03980
285.8626 14.16212
286.3447 14.25722
286.8268 14.33147
287.3089 14.49899
287.7910 14.66446
288.2732 15.01032
288.7553 15.89951
289.2374 16.99118
289.7195 17.61745
290.2016 17.34530
290.6837 16.35165
291.1659 15.60192
291.6480 14.83637
292.1301 14.61868
292.6122 15.49176
293.0943 16.85921
293.5764 17.90597
294.0586 18.25964
294.5407 18.10746
295.0228 17.95551
295.5049 17.83403
295.9870 17.67381
296.4691 17.42937
296.9513 17.16387
297.4334 16.93842
297.9155 16.77493
298.3976 16.66705
298.8797 16.61816
299.3618 16.77422
299.8440 16.68784
300.3261 15.99812
300.8082 15.29691
301.2903 15.25363
301.7724 15.91373
302.2545 16.52982
302.7367 16.14568
303.2188 14.32525
303.7009 13.20818
304.1830 12.90532
304.6651 13.12682
305.1472 14.02812
305.6294 15.41252
306.1115 16.55312
306.5936 16.77293
307.0757 16.00383
307.5578 15.57671
308.0399 15.49332
308.5221 15.67437
309.0042 16.37921
309.4863 17.35142
309.9684 17.91826
310.4505 17.58403
310.9326 16.52666
311.4148 16.02695
311.8969 16.52303
312.3790 16.98930
312.8611 17.20841
313.3432 17.22384
313.8253 17.05388
314.3075 16.68572
314.7896 16.27962
315.2717 16.26562
315.7538 17.22431
316.2359 17.73398
316.7180 17.24348
317.2001 16.44083
317.6823 16.12560
318.1644 16.51854
318.6465 17.21925
319.1286 17.64645
319.6107 17.73180
320.0928 17.64781
320.5750 17.29063
321.0571 16.84509
321.5392 16.33104
322.0213 15.80937
322.5034 15.54392
322.9855 15.89234
323.4677 17.03168
323.9498 17.38614
324.4319 16.32653
324.9140 15.19130
325.3961 14.59306
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326.3604 14.67818
326.8425 15.01947
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327.8067 15.37035
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328.7709 13.44947
329.2531 12.93502
329.7352 12.65148
330.2173 12.25121
330.6994 11.57996
331.1815 10.84993
331.6636 10.53326
332.1458 11.53244
332.6279 11.61926
333.1100 9.838531
333.5921 7.643471
334.0742 6.566078
334.5563 7.018295
335.0385 8.191086
335.5206 8.827850
336.0027 8.562103
336.4848 8.437698
336.9669 8.760773
337.4490 9.050179
337.9312 8.834999
338.4133 8.102440
338.8954 7.268131
339.3775 6.783081
339.8596 6.690201
340.3417 6.594471
340.8239 6.563942
341.3060 6.481216
341.7881 6.201714
342.2702 5.825214
342.7523 5.566196
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344.1987 6.186558
344.6808 7.145775
345.1629 7.550865
345.6450 6.856419
346.1271 5.736389
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347.0914 4.446899
347.5735 4.387318
348.0556 4.427021
348.5377 4.596306
349.0198 4.821541
349.5020 5.110649
349.9841 5.497692
350.4662 5.986626
350.9483 6.507881
351.4304 6.975834
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352.3947 7.378681
352.8768 7.441174
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354.8052 8.279362
355.2874 8.699463
355.7695 8.509575
356.2516 7.858635
356.7337 7.593307
357.2158 7.930897
357.6979 8.402378
358.1800 9.134987
358.6621 9.849968
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359.6264 9.972477
360.1085 9.566475
360.5906 9.579678
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361.5548 10.73477
362.0370 10.73419
362.5191 10.77231
363.0012 11.22303
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365.4118 15.65365
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366.3760 16.78934
366.8581 17.23243
367.3402 17.56086
367.8224 17.68099
368.3045 17.53078
368.7866 17.14214
369.2687 16.57077
369.7508 15.72186
370.2329 14.90145
370.7151 14.30811
371.1972 13.74650
371.6793 12.98474
372.1614 11.94682
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373.1256 9.877384
373.6078 9.111084
374.0899 8.329269
374.5720 7.417953
375.0541 6.548405
375.5362 5.786453
376.0183 5.147865
376.5005 4.735771
376.9826 4.810753
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378.9110 4.008015
379.3932 3.255669
379.8753 2.510620
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380.8395 1.682068
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381.8037 1.457760
382.2859 1.377674
382.7680 1.120434
383.2501 0.4151190
383.7322 0.3939670
384.2143 0.7668910
384.6964 0.6044460
385.1786 0.3086320
385.6607 5.4170000E-03
386.1428 0.2599450
386.6249 0.3695980
387.1070 0.2972110
387.5891 5.8075000E-02
388.0713 0.5738370
388.5534 1.549141
389.0355 1.898438
389.5176 0.8227390
389.9997 0.5935360
390.4818 1.297897
390.9640 1.244720
391.4461 0.8159980
391.9282 9.4581999E-02
392.4103 0.7665180
392.8924 1.020496
393.3745 0.1086200
393.8567 0.9492030
394.3388 0.4882510
394.8209 0.6156160
395.3030 1.184177
395.7851 0.7543600
396.2672 0.1769030
396.7494 0.7319640
397.2315 0.7994650
397.7136 0.7452240
398.1957 0.4598460
398.6778 0.1422960
399.1599 7.3589999E-03
399.6420 5.3710002E-03
400.1241 1.7952001E-02
400.6063 0.2830850
401.0884 0.8045460
401.5705 0.9964900
402.0526 0.9195400
402.5347 0.5092240
403.0168 0.6654660
403.4990 2.108818
403.9811 2.999493
404.4632 2.936913
404.9453 2.251312
405.4274 1.741306
405.9095 1.629539
406.3917 1.326130
406.8738 0.3857730
407.3559 0.4193150
407.8380 0.3580740
408.3201 0.5293430
408.8022 1.480518
409.2844 1.680882
409.7665 1.060879
410.2486 0.8022270
410.7307 1.253231
411.2128 1.716461
411.6949 1.926361
412.1771 2.004807
412.6592 2.241131
413.1413 2.832306
413.6234 3.475353
414.1055 3.371773
414.5876 2.114399
415.0698 1.399662
415.5519 2.015919
416.0340 2.963821
416.5161 3.777454
416.9982 4.398994
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