#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 14:01:33 +0300 (Thu, 26 Apr 2018) $
#$Revision: 609 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000148.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_1000148
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'
_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 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            R120127.rod
_rod_data_source.block           3500000
_rod_database.code               1000148
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
109.0379 0.0000000E+00
109.5200 9.1003001E-02
110.0021 0.7614140
110.4842 6.821655
110.9664 10.18817
111.4485 8.335754
111.9306 5.970459
112.4127 5.147644
112.8948 6.259888
113.3769 8.411621
113.8591 10.42169
114.3412 12.20306
114.8233 13.92487
115.3054 16.32965
115.7875 18.51495
116.2696 19.09399
116.7517 17.28784
117.2339 14.40845
117.7160 14.31934
118.1981 18.36639
118.6802 21.81891
119.1623 23.29669
119.6444 23.20660
120.1266 22.68939
120.6087 22.06110
121.0908 21.85852
121.5729 22.72333
122.0550 24.36621
122.5371 26.28656
123.0193 28.59088
123.5014 30.92444
123.9835 31.71344
124.4656 30.61322
124.9477 28.96985
125.4298 27.06470
125.9120 24.93414
126.3941 22.85217
126.8762 21.40863
127.3583 21.11340
127.8404 20.52649
128.3225 19.11890
128.8047 17.23938
129.2868 15.31635
129.7689 13.63818
130.2510 12.17578
130.7331 10.46631
131.2152 8.090210
131.6974 5.828369
132.1795 3.742371
132.6616 1.918091
133.1437 0.5198360
133.6258 0.2885740
134.1079 0.4094850
134.5901 0.5549320
135.0722 0.6063840
135.5543 0.7099610
136.0364 1.066040
136.5185 1.648193
137.0006 2.102600
137.4828 2.164185
137.9649 1.929565
138.4470 0.8013920
138.9291 2.130798
139.4112 5.573059
139.8933 7.972534
140.3755 8.845154
140.8576 9.250732
141.3397 10.72614
141.8218 13.21649
142.3039 15.50000
142.7860 17.08722
143.2681 18.06927
143.7503 18.64740
144.2324 18.53278
144.7145 18.37787
145.1966 18.69958
145.6787 19.46582
146.1608 20.55505
146.6430 22.11945
147.1251 24.23962
147.6072 25.93744
148.0893 26.56531
148.5714 26.93884
149.0535 27.45465
149.5357 28.21124
150.0178 29.14685
150.4999 30.17297
150.9820 31.24042
151.4641 32.45892
151.9462 34.24615
152.4284 35.94385
152.9105 36.85046
153.3926 36.77362
153.8747 36.23260
154.3568 36.42273
154.8389 37.88232
155.3211 39.54596
155.8032 41.88141
156.2853 44.23822
156.7674 45.71362
157.2495 45.81244
157.7316 44.93414
158.2138 44.78955
158.6959 46.89185
159.1780 47.94928
159.6601 46.60779
160.1422 43.62378
160.6243 40.70770
161.1065 39.21875
161.5886 39.30023
162.0707 39.63104
162.5528 39.60126
163.0349 39.22211
163.5170 38.29529
163.9991 36.26526
164.4813 34.03760
164.9634 32.39154
165.4455 31.43384
165.9276 30.75714
166.4097 30.53766
166.8918 30.52161
167.3740 29.56476
167.8561 27.42682
168.3382 25.60284
168.8203 25.41486
169.3024 25.97858
169.7845 26.26666
170.2667 25.76178
170.7488 24.82001
171.2309 24.19275
171.7130 23.73578
172.1951 23.94995
172.6772 25.51312
173.1594 27.65814
173.6415 29.25372
174.1236 29.52753
174.6057 28.72699
175.0878 28.36627
175.5699 29.00299
176.0521 29.48389
176.5342 29.48718
177.0163 29.12427
177.4984 28.61603
177.9805 28.09387
178.4626 27.55298
178.9448 27.11725
179.4269 27.14563
179.9090 26.92206
180.3911 25.85400
180.8732 24.28119
181.3553 23.13818
181.8375 23.33441
182.3196 25.11639
182.8017 25.77478
183.2838 24.66125
183.7659 23.26898
184.2480 22.20734
184.7301 21.53595
185.2123 21.07843
185.6944 20.67102
186.1765 20.31012
186.6586 20.19299
187.1407 20.55591
187.6228 20.99255
188.1050 21.20038
188.5871 21.14648
189.0692 20.98242
189.5513 20.81421
190.0334 20.64954
190.5155 20.59375
190.9977 20.46936
191.4798 20.54370
191.9619 21.41119
192.4440 23.30756
192.9261 25.09106
193.4082 25.31708
193.8904 24.42139
194.3725 23.66754
194.8546 23.14185
195.3367 23.09375
195.8188 24.14954
196.3009 26.80414
196.7831 29.84698
197.2652 32.54376
197.7473 34.84235
198.2294 36.51178
198.7115 37.12402
199.1936 36.94629
199.6758 37.08722
200.1579 37.62842
200.6400 38.42334
201.1221 39.47998
201.6042 40.69843
202.0863 41.83588
202.5685 42.65155
203.0506 43.17590
203.5327 43.94476
204.0148 45.42786
204.4969 46.65875
204.9790 47.57660
205.4612 47.99048
205.9433 47.49353
206.4254 45.49689
206.9075 41.88293
207.3896 39.07153
207.8717 38.78949
208.3539 37.75195
208.8360 34.43146
209.3181 29.34662
209.8002 24.07159
210.2823 20.04022
210.7644 17.47803
211.2466 14.41248
211.7287 10.39569
212.2108 6.361694
212.6929 2.499390
213.1750 1.082153
213.6571 4.343018
214.1393 7.297668
214.6214 10.05219
215.1035 11.56580
215.5856 10.82904
216.0677 10.04456
216.5498 10.61591
217.0320 12.32831
217.5141 13.82739
217.9962 13.81799
218.4783 12.06927
218.9604 10.60931
219.4425 9.271729
219.9247 8.317139
220.4068 8.127747
220.8889 8.613403
221.3710 9.124878
221.8531 9.144226
222.3352 8.616516
222.8174 7.829895
223.2995 6.366882
223.7816 4.944336
224.2637 4.293091
224.7458 4.401550
225.2279 4.380371
225.7100 3.400757
226.1922 1.573730
226.6743 2.1118000E-02
227.1564 0.7673340
227.6385 1.522827
228.1206 2.993164
228.6027 5.226379
229.0849 7.604065
229.5670 9.934326
230.0491 12.04712
230.5312 13.47174
231.0133 13.24219
231.4954 12.76947
231.9776 13.69763
232.4597 16.14575
232.9418 19.13617
233.4239 22.76300
233.9060 26.41919
234.3881 28.98804
234.8703 29.30157
235.3524 29.15381
235.8345 31.29535
236.3166 36.30304
236.7987 41.25031
237.2808 44.58728
237.7630 47.04694
238.2451 49.28369
238.7272 51.32971
239.2093 53.48132
239.6914 56.29852
240.1735 60.02209
240.6557 63.70239
241.1378 67.34027
241.6199 70.60406
242.1020 73.07874
242.5841 74.56213
243.0662 75.37225
243.5484 75.82654
244.0305 75.49677
244.5126 76.03552
244.9947 78.82605
245.4768 82.13617
245.9589 84.45203
246.4410 85.24164
246.9232 85.17029
247.4053 85.30493
247.8874 85.59100
248.3695 86.25305
248.8516 87.79242
249.3337 89.39941
249.8159 90.49963
250.2980 90.91351
250.7801 90.76190
251.2622 90.12976
251.7443 88.63000
252.2264 87.52911
252.7086 86.94739
253.1907 86.72589
253.6728 87.00226
254.1549 87.72437
254.6370 88.35626
255.1191 87.81384
255.6013 84.67688
256.0834 83.53235
256.5655 85.54889
257.0476 88.39227
257.5297 90.87329
258.0118 92.61755
258.4940 93.61969
258.9761 93.72998
259.4582 92.25696
259.9403 91.67102
260.4224 91.48755
260.9045 92.32574
261.3867 95.11194
261.8688 99.63074
262.3509 104.4342
262.8330 107.8483
263.3151 109.4091
263.7972 111.1988
264.2794 113.2821
264.7615 115.4856
265.2436 117.2295
265.7257 118.7961
266.2078 121.3664
266.6899 126.2687
267.1721 133.9941
267.6542 140.8900
268.1363 146.7437
268.6184 152.1417
269.1005 157.1118
269.5826 161.7973
270.0648 166.4819
270.5469 171.2994
271.0290 176.1043
271.5111 181.4135
271.9932 187.3749
272.4753 193.5586
272.9575 200.0365
273.4396 206.8128
273.9217 213.5020
274.4038 219.6845
274.8859 225.3913
275.3680 231.8022
275.8501 239.1183
276.3322 247.0232
276.8144 255.4656
277.2965 264.4059
277.7786 273.9231
278.2607 284.2220
278.7428 294.7722
279.2249 303.4084
279.7071 307.7296
280.1892 313.4633
280.6713 323.8750
281.1534 336.5094
281.6355 346.5823
282.1176 351.7012
282.5998 353.9461
283.0819 358.7241
283.5640 367.3732
284.0461 375.8324
284.5282 383.0878
285.0103 389.5945
285.4925 395.9947
285.9746 402.4815
286.4567 409.1613
286.9388 416.3649
287.4209 424.2532
287.9030 431.9779
288.3852 439.6336
288.8673 446.9250
289.3494 453.0612
289.8315 457.8082
290.3136 462.5901
290.7957 469.5501
291.2779 479.0766
291.7600 487.4530
292.2421 493.5052
292.7242 498.7004
293.2063 504.5441
293.6884 511.2430
294.1706 517.8338
294.6527 523.4356
295.1348 527.9913
295.6169 532.3741
296.0990 536.6299
296.5811 540.7089
297.0633 544.7141
297.5454 548.5915
298.0275 551.9501
298.5096 554.4589
298.9917 556.1401
299.4738 557.6263
299.9560 559.1696
300.4381 560.2946
300.9202 560.9205
301.4023 560.9570
301.8844 560.0037
302.3665 557.7287
302.8487 554.3301
303.3308 550.6088
303.8129 546.9108
304.2950 542.3870
304.7771 536.6217
305.2592 529.7356
305.7414 521.9800
306.2235 513.3845
306.7056 504.0864
307.1877 494.3867
307.6698 484.3474
308.1519 473.9042
308.6341 463.3383
309.1162 452.3185
309.5983 440.2271
310.0804 426.8428
310.5625 412.8667
311.0446 399.2814
311.5268 386.0403
312.0089 372.8975
312.4910 359.4556
312.9731 346.2600
313.4552 334.0778
313.9373 323.0889
314.4195 312.1839
314.9016 300.0278
315.3837 286.7411
315.8658 274.5817
316.3479 264.2785
316.8300 254.7604
317.3121 244.9654
317.7943 234.9329
318.2764 225.8557
318.7585 218.4873
319.2406 212.8317
319.7227 207.9782
320.2048 204.2890
320.6870 200.8970
321.1691 197.1182
321.6512 193.2403
322.1333 190.1420
322.6154 188.3115
323.0975 187.4487
323.5797 186.8260
324.0618 186.2592
324.5439 186.2526
325.0260 186.9836
325.5081 188.3976
325.9902 190.2482
326.4724 192.3668
326.9545 195.3541
327.4366 200.4615
327.9187 207.9086
328.4008 215.5060
328.8829 222.6369
329.3651 229.8013
329.8472 237.7064
330.3293 246.4423
330.8114 255.2225
331.2935 263.1534
331.7756 270.1555
332.2578 278.1269
332.7399 288.0071
333.2220 298.1462
333.7041 307.5425
334.1862 316.1094
334.6683 324.2083
335.1505 332.2020
335.6326 339.8442
336.1147 345.6535
336.5968 348.8068
337.0789 351.1715
337.5610 354.1321
338.0432 357.0192
338.5253 358.0568
339.0074 356.3410
339.4895 352.4722
339.9716 347.9245
340.4537 343.0005
340.9359 337.1799
341.4180 330.1013
341.9001 321.9917
342.3822 313.1143
342.8643 303.6093
343.3464 293.8588
343.8286 284.4549
344.3107 275.7441
344.7928 266.3612
345.2749 255.8409
345.7570 244.9495
346.2391 234.0591
346.7213 223.4001
347.2034 213.2655
347.6855 204.1827
348.1676 196.1817
348.6497 187.2008
349.1318 176.0543
349.6140 165.3156
350.0961 156.3377
350.5782 148.7303
351.0603 141.3312
351.5424 133.4634
352.0245 125.4192
352.5067 118.3939
352.9888 113.6919
353.4709 108.4314
353.9530 101.5009
354.4351 94.12845
354.9172 87.69266
355.3994 82.68835
355.8815 78.69870
356.3636 75.02707
356.8457 72.04633
357.3278 68.57648
357.8099 64.14215
358.2920 59.62131
358.7741 55.50330
359.2563 51.88263
359.7384 48.81317
360.2205 46.41293
360.7026 44.80130
361.1847 42.68033
361.6668 39.83765
362.1490 36.75323
362.6311 33.31699
363.1132 29.75955
363.5953 26.55801
364.0774 24.00912
364.5595 21.98355
365.0417 19.92532
365.5238 17.73712
366.0059 15.64798
366.4880 13.49387
366.9701 11.54587
367.4522 10.19608
367.9344 9.542145
368.4165 9.120331
368.8986 8.171509
369.3807 6.455872
369.8628 4.868896
370.3449 3.281342
370.8271 1.942047
371.3092 1.105621
371.7913 0.6924130
372.2734 0.2877500
372.7555 0.5244750
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373.7198 2.538300
374.2019 2.489136
374.6840 2.676056
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375.6482 5.169983
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376.6125 6.939575
377.0946 7.016785
377.5767 6.552246
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379.0230 3.679199
379.5052 3.320038
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380.9515 1.235016
381.4336 0.7865600
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382.8800 0.7342530
383.3621 1.029327
383.8442 1.685333
384.3263 2.605804
384.8084 3.489502
385.2906 4.168121
385.7727 4.681671
386.2548 5.166962
386.7369 5.672180
387.2190 5.958221
387.7011 5.718231
388.1833 5.214630
388.6654 4.804474
389.1475 4.564331
389.6296 4.394867
390.1117 4.176422
390.5938 3.930145
391.0760 3.832275
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392.0402 4.280029
392.5223 4.408691
393.0044 4.439117
393.4865 4.098816
393.9687 2.918823
394.4508 1.413422
394.9329 0.4216000
395.4150 8.5083000E-02
395.8971 7.3850001E-03
396.3792 0.1461490
396.8614 0.3470460
397.3435 0.3469850
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398.3077 0.9703060
398.7898 0.1198120
399.2719 1.745148
399.7540 3.415924
400.2361 4.329773
400.7183 4.604370
401.2004 4.481934
401.6825 3.400970
402.1646 2.934387
402.6467 3.984528
403.1288 5.526459
403.6110 6.236725
404.0931 5.861542
404.5752 5.333862
405.0573 5.812408
405.5394 7.633240
406.0215 8.849365
406.5037 9.049438
406.9858 9.066467
407.4679 9.215027
407.9500 9.572327
408.4321 10.23889
408.9142 11.31277
409.3964 12.57242
409.8785 13.11835
410.3606 12.11804
410.8427 11.56750
411.3248 11.85046
411.8069 12.54443
412.2891 13.18976
412.7712 13.65195
413.2533 14.15744
413.7354 15.14343
414.2175 16.88519
414.6996 18.26224
415.1818 18.95831
415.6639 19.60330
416.1460 20.36163
416.6281 21.21295
417.1102 22.09085
417.5923 22.92661
418.0745 23.79150
418.5566 24.95212
419.0387 26.55908
419.5208 28.12378
420.0029 29.85114
420.4850 31.18411
420.9672 31.42059
421.4493 30.44305
421.9314 29.35086
422.4135 29.17419
422.8956 29.82980
423.3777 30.69809
423.8599 31.91013
424.3420 33.08801
424.8241 34.00323
425.3062 34.64850
425.7883 35.01163
426.2704 34.81863
426.7526 34.50345
427.2347 34.83441
427.7168 35.86417
428.1989 36.66547
428.6810 36.54984
429.1631 35.98627
429.6453 36.07169
430.1274 37.12976
430.6095 38.09677
431.0916 38.55408
431.5737 38.52026
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