#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-05-24 16:08:35 +0300 (Thu, 24 May 2018) $
#$Revision: 876 $
#$URL: svn://172.16.1.111/rod/cif/1/00/03/1000357.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_1000357
loop_
_publ_author_name
'Andrade, M. B.'
'Atencio, D.'
'Menezes, L. A. D.'
'Ellena, J.'
_publ_section_title
;
 The crystal structure of a microlite-group mineral with a formula near
 NaCaTa2O6F from the Morro Redondo mine, Coronel Murta, Minas Gerias,
 Brazil
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              615
_journal_page_last               621
_journal_paper_doi               10.3749/canmin.49.2.615
_journal_volume                  49
_journal_year                    2011
_chemical_compound_source
'Morro Redondo mine, Coronel Murta, Minas Gerias, Brazil 3'
_chemical_formula_sum
'As0.04 Ca0.88 F0.73 H0.24 Na0.88 Nb0.14 O6 Pb0.02 Si0.12 Ta1.7'
_chemical_name_mineral           Fluornatromicrolite
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.4396
_cell_length_b                   10.4396
_cell_length_c                   10.4396
_cell_volume                     1137.762
_exptl_crystal_density_diffrn    5.800
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_original_formula_sum
'Na.88 Ca.88 Pb.02 (Ta1.7 Nb.14 Si.12 As.04) O6 F.73 H.24'
_cod_database_code               9014190
_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            R120140.rod
_rod_data_source.block           3500000
_rod_database.code               1000357
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 9014190 COD http://www.crystallography.net/cod/9014190.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
150.1083 0.0000000E+00
150.5905 0.2139360
151.0726 0.5530280
151.5547 1.671993
152.0368 2.769114
152.5189 3.538813
153.0010 3.584789
153.4832 3.901918
153.9653 4.863304
154.4474 5.853500
154.9295 6.480110
155.4116 6.826960
155.8937 7.171452
156.3759 7.332314
156.8580 7.817953
157.3401 8.950535
157.8222 9.817461
158.3043 9.611559
158.7864 8.999180
159.2686 7.877748
159.7507 6.624996
160.2328 5.431622
160.7149 4.237846
161.1970 3.189074
161.6791 2.416615
162.1613 1.871624
162.6434 1.281212
163.1255 0.3640100
163.6076 0.5810470
164.0897 1.287605
164.5718 1.665257
165.0540 1.788597
165.5361 1.582710
166.0182 1.057884
166.5003 0.5868490
166.9824 0.6405370
167.4645 0.7736020
167.9467 0.4544910
168.4288 0.7773510
168.9109 2.366703
169.3930 3.879642
169.8751 5.301025
170.3572 6.959881
170.8394 9.215763
171.3215 11.88928
171.8036 14.62138
172.2857 17.27119
172.7678 19.93295
173.2499 22.78396
173.7321 25.91118
174.2142 28.86077
174.6963 31.25861
175.1784 33.25451
175.6605 35.21590
176.1426 37.35285
176.6248 39.53046
177.1069 41.55871
177.5890 43.43427
178.0711 45.15228
178.5532 46.56364
179.0353 47.78788
179.5175 49.15760
179.9996 51.01115
180.4817 53.12836
180.9638 55.13258
181.4459 56.96904
181.9280 58.73046
182.4102 60.50573
182.8923 62.28061
183.3744 64.29533
183.8565 66.69475
184.3386 69.44131
184.8207 72.38424
185.3029 75.65351
185.7850 78.90115
186.2671 81.45483
186.7492 83.33950
187.2313 85.38139
187.7134 88.10548
188.1956 91.48479
188.6777 95.26959
189.1598 99.60560
189.6419 104.1841
190.1240 108.4674
190.6061 112.5243
191.0883 116.1716
191.5704 119.1975
192.0525 121.6876
192.5346 124.1368
193.0167 126.6082
193.4988 128.9525
193.9810 130.4175
194.4631 130.8029
194.9452 131.0432
195.4273 130.6005
195.9094 129.5015
196.3915 129.5744
196.8737 131.6242
197.3558 134.8794
197.8379 136.9103
198.3200 137.8090
198.8021 137.2269
199.2842 134.2248
199.7664 128.6530
200.2485 123.9253
200.7306 120.8565
201.2127 119.1656
201.6948 117.2095
202.1769 114.8562
202.6591 112.6487
203.1412 111.2589
203.6233 110.8144
204.1054 110.1340
204.5875 108.8173
205.0696 106.9780
205.5518 105.7031
206.0339 105.0940
206.5160 104.7881
206.9981 104.4380
207.4802 104.0286
207.9623 103.5965
208.4445 103.2053
208.9266 102.8466
209.4087 102.2888
209.8908 101.4940
210.3729 100.5686
210.8550 99.58936
211.3372 98.50963
211.8193 97.55320
212.3014 96.86163
212.7835 96.43716
213.2656 95.66899
213.7477 94.51776
214.2299 93.08070
214.7120 91.40709
215.1941 89.34525
215.6762 87.44713
216.1583 85.89928
216.6404 84.73190
217.1226 83.42563
217.6047 81.96884
218.0868 80.38155
218.5689 78.65079
219.0510 76.69244
219.5331 74.78241
220.0153 73.01149
220.4974 71.39769
220.9795 69.62376
221.4616 67.60132
221.9437 65.49829
222.4258 63.52652
222.9080 61.81679
223.3901 60.04602
223.8722 58.13567
224.3543 56.02797
224.8364 53.99261
225.3185 51.98790
225.8007 50.10864
226.2828 48.50156
226.7649 47.42224
227.2470 46.05531
227.7291 44.09663
228.2112 41.40472
228.6934 39.05945
229.1755 37.16011
229.6576 35.51321
230.1397 33.92873
230.6218 32.52003
231.1039 30.93771
231.5861 29.02420
232.0682 26.66573
232.5503 24.68031
233.0324 23.19014
233.5145 21.97806
233.9966 20.75740
234.4788 19.45572
234.9609 18.30261
235.4430 17.49176
235.9251 17.16563
236.4072 16.10381
236.8893 13.72208
237.3715 11.08264
237.8536 9.619873
238.3357 10.19667
238.8178 10.39830
239.2999 9.415192
239.7820 6.996216
240.2642 5.345993
240.7463 4.793579
241.2284 4.723846
241.7105 4.373489
242.1926 3.506500
242.6747 2.783813
243.1569 2.410568
243.6390 2.442642
244.1211 2.350937
244.6032 2.066299
245.0853 1.722382
245.5674 1.481598
246.0496 1.415131
246.5317 1.317291
247.0138 1.071320
247.4959 0.6349330
247.9780 0.6125030
248.4601 1.192123
248.9423 2.007568
249.4244 2.619034
249.9065 2.775391
250.3886 3.251511
250.8707 4.393799
251.3528 6.244324
251.8350 7.498077
252.3171 7.925018
252.7992 7.987961
253.2813 8.093964
253.7634 8.105988
254.2455 8.456161
254.7277 9.382111
255.2098 10.90396
255.6919 11.93365
256.1740 12.35089
256.6561 12.42114
257.1382 12.33160
257.6204 11.95930
258.1025 11.72636
258.5846 11.72797
259.0667 11.95535
259.5488 12.24164
260.0309 12.66084
260.5131 13.01543
260.9952 13.10876
261.4773 12.88503
261.9594 12.56104
262.4415 12.09122
262.9236 11.51643
263.4058 11.20158
263.8879 11.03568
264.3700 11.32191
264.8521 12.56142
265.3342 15.26662
265.8163 17.14078
266.2985 17.72607
266.7806 17.18896
267.2627 16.34755
267.7448 14.97836
268.2269 13.77811
268.7090 13.31624
269.1912 13.75148
269.6733 14.22910
270.1554 14.62022
270.6375 14.98286
271.1196 15.52690
271.6017 16.26006
272.0839 17.14236
272.5660 18.16685
273.0481 19.37228
273.5302 20.50746
274.0123 21.57651
274.4944 22.55864
274.9766 23.34607
275.4587 23.86270
275.9408 24.47772
276.4229 25.46346
276.9050 26.86565
277.3871 28.13303
277.8693 29.20570
278.3514 30.15240
278.8335 31.07538
279.3156 31.96387
279.7977 32.96353
280.2798 34.28529
280.7620 35.92006
281.2441 37.12292
281.7262 37.71452
282.2083 38.11530
282.6904 39.11856
283.1725 40.75842
283.6547 42.48648
284.1368 44.07574
284.6189 45.51732
285.1010 46.86024
285.5831 48.07559
286.0652 49.27356
286.5474 50.61972
287.0295 52.11131
287.5116 53.64752
287.9937 55.29089
288.4758 56.99240
288.9579 58.30626
289.4401 59.19940
289.9222 59.96399
290.4043 60.91031
290.8864 62.03149
291.3685 63.27240
291.8506 64.55724
292.3328 65.95029
292.8149 67.74100
293.2970 69.97957
293.7791 72.10831
294.2612 72.99968
294.7433 73.11238
295.2255 74.41539
295.7076 78.72108
296.1897 83.95712
296.6718 85.54451
297.1539 83.56015
297.6360 80.83429
298.1182 79.49033
298.6003 79.25339
299.0824 79.42719
299.5645 79.90657
300.0466 80.62302
300.5287 81.70131
301.0109 83.05595
301.4930 84.10390
301.9751 84.23703
302.4572 83.80652
302.9393 83.39777
303.4214 83.14346
303.9036 82.93021
304.3857 82.77834
304.8678 82.61186
305.3499 82.13600
305.8320 81.25549
306.3141 79.93506
306.7963 78.05862
307.2784 75.44171
307.7605 72.69707
308.2426 70.22339
308.7247 67.99699
309.2068 65.96358
309.6890 64.44153
310.1711 62.89026
310.6532 60.79163
311.1353 58.01018
311.6174 55.11661
312.0995 52.28555
312.5817 49.64024
313.0638 47.33806
313.5459 45.81226
314.0280 44.35031
314.5101 42.49129
314.9922 40.19742
315.4744 37.81705
315.9565 35.19072
316.4386 32.69301
316.9207 30.78113
317.4028 30.40965
317.8849 29.91046
318.3671 28.36673
318.8492 25.81914
319.3313 23.65849
319.8134 22.56287
320.2955 21.93190
320.7776 21.30580
321.2598 20.71172
321.7419 19.95602
322.2240 18.88353
322.7061 17.57195
323.1882 16.39055
323.6703 15.12602
324.1525 14.14690
324.6346 13.68784
325.1167 14.49382
325.5988 14.94302
326.0809 14.69901
326.5630 13.99155
327.0452 13.45517
327.5273 13.35951
328.0094 13.18074
328.4915 12.69699
328.9736 11.71359
329.4557 10.98076
329.9379 10.51686
330.4200 10.31577
330.9021 10.37901
331.3842 10.87097
331.8663 11.36235
332.3484 11.69029
332.8306 11.74431
333.3127 11.72160
333.7948 11.68546
334.2769 11.67207
334.7590 11.74011
335.2411 12.10625
335.7233 12.20456
336.2054 11.79619
336.6875 10.92239
337.1696 10.51949
337.6517 10.62808
338.1339 11.01274
338.6160 11.58755
339.0981 12.42712
339.5802 13.11096
340.0623 13.50328
340.5444 13.72952
341.0266 14.26126
341.5087 15.14520
341.9908 16.08316
342.4729 16.86737
342.9550 17.46118
343.4371 17.91959
343.9193 18.24559
344.4014 18.46165
344.8835 18.58875
345.3656 18.65379
345.8477 18.82922
346.3298 19.17168
346.8120 19.63499
347.2941 20.16925
347.7762 20.80544
348.2583 21.34633
348.7404 21.50311
349.2225 21.35829
349.7047 21.22664
350.1868 21.14893
350.6689 21.20267
351.1510 21.64082
351.6331 22.44757
352.1152 23.15439
352.5974 23.30515
353.0795 23.05406
353.5616 22.70795
354.0437 22.34235
354.5258 22.08705
355.0079 22.07399
355.4901 22.13689
355.9722 22.10600
356.4543 21.69379
356.9364 21.17055
357.4185 20.83772
357.9006 20.82773
358.3828 20.80382
358.8649 20.67429
359.3470 20.37590
359.8291 19.78297
360.3112 18.47667
360.7933 17.13188
361.2755 16.06706
361.7576 15.29675
362.2397 14.94359
362.7218 15.45818
363.2039 16.26709
363.6860 16.72847
364.1682 16.10994
364.6503 15.66275
365.1324 15.82661
365.6145 16.58971
366.0966 17.45467
366.5787 18.56955
367.0609 19.61957
367.5430 20.40350
368.0251 20.71458
368.5072 20.98151
368.9893 21.35878
369.4714 21.73233
369.9536 21.69225
370.4357 21.04053
370.9178 20.18245
371.3999 19.27451
371.8820 18.31940
372.3641 17.30569
372.8463 16.31833
373.3284 15.22534
373.8105 13.72592
374.2926 11.49727
374.7747 9.576767
375.2568 8.257568
375.7390 7.540009
376.2211 7.144882
376.7032 7.212997
377.1853 7.301010
377.6674 6.916763
378.1495 5.992432
378.6317 5.197464
379.1138 4.707291
379.5959 4.398361
380.0780 3.776337
380.5601 2.798447
381.0422 2.017258
381.5244 2.089508
382.0065 2.798004
382.4886 2.835419
382.9707 1.958313
383.4528 0.7280880
383.9349 0.2088780
384.4171 0.8463440
384.8992 1.172028
385.3813 0.9164730
385.8634 0.4298400
386.3455 0.3192600
386.8276 0.6145630
387.3098 1.071945
387.7919 1.656647
388.2740 2.238052
388.7561 2.601715
389.2382 2.908615
389.7203 2.752686
390.2025 1.356476
390.6846 0.9754640
391.1667 2.855988
391.6488 3.592239
392.1309 3.468063
392.6130 2.615158
393.0952 0.7567140
393.5773 1.130981
394.0594 2.811005
394.5415 4.213318
395.0236 5.207428
395.5057 5.435257
395.9879 5.524017
396.4700 5.709427
396.9521 6.021927
397.4342 6.336960
397.9163 6.652374
398.3984 6.952042
398.8806 7.221146
399.3627 7.723541
399.8448 7.886017
400.3269 7.512451
400.8090 6.676086
401.2911 5.955063
401.7733 5.238098
402.2554 4.753143
402.7375 4.680542
403.2196 5.311462
403.7017 5.610916
404.1838 5.490143
404.6660 5.092285
405.1481 4.674118
405.6302 4.202713
406.1123 3.805588
406.5944 3.535019
407.0765 3.383362
407.5587 3.296036
408.0408 3.290558
408.5229 3.271957
409.0050 3.178085
409.4871 3.006561
409.9692 2.626740
410.4514 1.878998
410.9335 1.047348
411.4156 1.073380
411.8977 1.844894
412.3798 1.960922
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413.3441 3.410919
413.8262 5.972076
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415.2725 8.983505
415.7546 8.930893
416.2368 8.562973
416.7189 8.037857
417.2010 7.157974
417.6831 5.460068
418.1652 3.023102
418.6473 0.9765630
419.1295 7.4051000E-02
419.6116 0.2212830
420.0937 0.3794250
420.5758 0.5467830
421.0579 0.5377040
421.5400 0.1263280
422.0222 0.5162350
422.5043 1.001602
422.9864 1.276825
423.4685 1.337082
423.9506 1.078461
424.4327 0.2614140
424.9149 6.7580998E-02
425.3970 0.4905090
425.8791 1.345291
426.3612 1.950256
426.8433 2.332932
427.3254 2.370285
427.8076 1.808273
428.2897 0.8044430
428.7718 0.5624390
429.2539 1.395401
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430.2181 2.666565
430.7003 2.272308
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433.5930 2.370682
434.0751 2.418640
434.5572 2.976456
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435.5214 3.475632
436.0035 3.744202
436.4857 4.610001
436.9678 5.834961
437.4499 6.838165
437.9320 7.378006
438.4141 7.822403
438.8962 8.538879
439.3784 9.540100
439.8605 10.77585
440.3426 12.11667
440.8247 13.62671
441.3068 15.51880
441.7889 17.83481
442.2711 20.02460
442.7532 21.55881
443.2353 22.97528
443.7174 24.80881
444.1995 27.25351
444.6816 30.00870
445.1638 33.01086
445.6459 36.23877
446.1280 39.80606
446.6101 43.93567
447.0922 48.26102
447.5743 52.67719
448.0565 57.13641
448.5386 61.97415
449.0207 66.91235
449.5028 72.22858
449.9849 78.25894
450.4670 85.26465
450.9492 92.35999
451.4313 99.22903
451.9134 105.9779
452.3955 113.0402
452.8776 120.2060
453.3597 128.0348
453.8419 137.1224
454.3240 147.3464
454.8061 157.4813
455.2882 167.3197
455.7703 177.0560
456.2524 186.8517
456.7346 196.7865
457.2167 206.2477
457.6988 214.7874
458.1809 223.0276
458.6630 232.6032
459.1451 243.3133
459.6273 253.6633
460.1094 262.6168
460.5915 270.3118
461.0736 276.8552
461.5557 282.2951
462.0378 286.8477
462.5200 290.0794
463.0021 292.6093
463.4842 295.5500
463.9663 301.3936
464.4484 305.9849
464.9305 306.5017
465.4127 302.5791
465.8948 299.4962
466.3769 298.9710
466.8590 299.2985
467.3411 299.2552
467.8232 298.7803
468.3054 297.9657
468.7875 296.5558
469.2696 294.8091
469.7517 293.4805
470.2338 292.8864
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