#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 14:00:34 +0300 (Thu, 26 Apr 2018) $
#$Revision: 594 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000134.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_1000134
loop_
_publ_author_name
'Rastsvetaeva, R. K.'
'Chukanov, N. V.'
'Pekov, I. V.'
'Shlyukova, Z. V.'
'Khomyakov, A. P.'
_publ_section_title
;
 Structures of two potassium-rich labuntsovites in relation to the crystal
 chemistry of minerals of the labuntsovite-nenadkevichite family Sample: I
;
_journal_name_full               'Crystallography Reports'
_journal_page_first              820
_journal_page_last               827
_journal_volume                  43
_journal_year                    1998
_chemical_compound_source        R110169
_chemical_formula_sum            'H15.68 K3.4 Mn0.2 Na2 Nb0.8 O32.4 Si8 Ti3.2'
_chemical_name_mineral           Labuntsovite-Mn
_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                 116.9
_cell_angle_gamma                90
_cell_length_a                   14.42
_cell_length_b                   13.91
_cell_length_c                   7.8
_cell_volume                     1395.254
_exptl_crystal_density_diffrn    2.800
_cod_original_formula_sum        'Na2 K3.4 (Ti3.2 Nb.8) Mn.2 Si8 O32.4 H15.68'
_cod_database_code               9012633
_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            R110169.rod
_rod_data_source.block           3500000
_rod_database.code               1000134
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 9012633 COD http://www.crystallography.net/cod/9012633.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
177.4203 0.0000000E+00
177.9024 1.487915
178.3845 2.887207
178.8666 4.230835
179.3488 2.252197
179.8309 0.1316530
180.3130 0.9772340
180.7951 0.7711180
181.2772 0.3480220
181.7593 1.7273000E-02
182.2415 0.6912230
182.7236 2.149963
183.2057 4.423035
183.6878 6.844177
184.1699 8.374390
184.6520 8.262207
185.1342 8.640015
185.6163 9.840515
186.0984 11.39783
186.5805 12.80792
187.0626 13.91345
187.5447 14.92078
188.0269 16.21399
188.5090 17.89850
188.9911 19.42255
189.4732 20.22833
189.9553 20.84943
190.4374 22.29633
190.9196 25.06714
191.4017 28.34229
191.8838 30.97107
192.3659 32.92365
192.8480 34.79895
193.3301 36.92859
193.8123 39.20355
194.2944 41.30908
194.7765 43.32605
195.2586 44.85980
195.7407 45.58270
196.2228 45.48157
196.7050 45.07153
197.1871 44.31659
197.6692 43.27496
198.1513 43.35303
198.6334 46.10925
199.1155 49.00433
199.5977 50.30011
200.0798 49.92010
200.5619 48.90021
201.0440 47.89917
201.5261 46.75342
202.0082 46.75323
202.4904 49.31763
202.9725 52.21558
203.4546 54.24182
203.9367 55.31189
204.4188 56.27368
204.9009 58.28467
205.3831 61.84430
205.8652 64.90247
206.3473 67.13336
206.8294 69.05963
207.3115 71.04138
207.7936 73.09497
208.2758 74.91754
208.7579 75.92920
209.2400 75.23468
209.7221 75.75903
210.2042 78.20905
210.6863 81.14728
211.1685 83.75574
211.6506 85.81146
212.1327 87.71149
212.6148 88.90356
213.0969 90.26672
213.5790 91.07935
214.0612 91.36078
214.5433 91.13678
215.0254 90.20355
215.5075 88.57935
215.9896 86.81232
216.4717 85.75128
216.9539 85.97827
217.4360 85.45093
217.9181 83.42242
218.4002 80.97974
218.8823 79.15735
219.3644 78.21234
219.8466 77.77673
220.3287 77.58197
220.8108 77.83984
221.2929 77.11462
221.7750 74.18506
222.2571 70.56122
222.7393 68.27856
223.2214 67.88733
223.7035 68.09149
224.1856 67.36963
224.6677 65.81970
225.1498 63.98401
225.6320 61.67981
226.1141 59.25195
226.5962 57.23047
227.0783 55.68164
227.5604 54.60406
228.0425 54.24701
228.5247 54.44098
229.0068 54.46735
229.4889 53.93732
229.9710 53.06274
230.4531 52.30304
230.9352 51.72949
231.4174 51.22632
231.8995 50.56622
232.3816 49.87000
232.8637 49.51807
233.3458 50.03693
233.8279 51.07446
234.3101 51.38147
234.7922 50.45996
235.2743 49.05615
235.7564 48.55304
236.2385 48.63409
236.7206 48.67230
237.2028 48.40387
237.6849 47.81628
238.1670 46.84528
238.6491 45.20868
239.1312 43.68500
239.6133 42.64758
240.0955 41.90405
240.5776 41.09253
241.0597 39.94049
241.5418 38.57050
242.0239 37.73102
242.5060 38.54565
242.9882 38.24835
243.4703 35.39166
243.9524 31.15985
244.4345 27.19958
244.9166 24.42865
245.3987 22.68317
245.8809 21.27844
246.3630 20.36310
246.8451 19.63983
247.3272 19.13593
247.8093 18.74652
248.2914 18.39746
248.7736 18.06323
249.2557 17.67358
249.7378 16.93677
250.2199 15.21869
250.7020 13.94208
251.1841 13.59406
251.6663 13.68451
252.1484 13.59625
252.6305 13.02130
253.1126 12.19623
253.5947 11.84534
254.0768 12.78461
254.5590 13.23389
255.0411 12.28601
255.5232 11.10706
256.0053 11.07922
256.4874 12.78613
256.9695 15.59991
257.4517 18.00171
257.9338 19.62268
258.4159 21.23077
258.8980 22.62183
259.3801 24.09100
259.8622 25.98016
260.3444 28.40155
260.8265 31.17047
261.3086 33.94159
261.7907 36.66901
262.2728 39.49048
262.7549 42.59229
263.2371 45.70306
263.7192 48.59363
264.2013 51.20105
264.6834 53.48187
265.1655 55.29089
265.6476 56.16248
266.1298 57.75439
266.6119 60.67767
267.0940 64.02283
267.5761 67.07153
268.0582 69.67151
268.5403 71.80737
269.0225 73.40265
269.5046 74.31281
269.9867 75.24487
270.4688 76.41431
270.9509 77.49200
271.4330 78.09448
271.9152 78.20343
272.3973 78.28735
272.8794 78.94775
273.3615 80.21179
273.8436 80.53516
274.3257 78.56018
274.8079 76.56592
275.2900 76.89264
275.7721 79.47437
276.2542 81.69373
276.7363 81.34796
277.2184 78.71033
277.7006 77.08917
278.1827 76.98816
278.6648 77.52722
279.1469 78.55188
279.6290 79.91614
280.1111 80.52185
280.5933 79.27136
281.0754 76.89221
281.5575 75.92651
282.0396 77.27924
282.5217 78.92896
283.0038 79.58154
283.4860 79.41669
283.9681 79.34723
284.4502 79.72473
284.9323 80.52124
285.4144 81.60889
285.8965 83.07129
286.3787 84.60144
286.8608 85.91815
287.3429 87.13623
287.8250 88.68884
288.3071 90.76935
288.7892 93.19165
289.2714 95.70135
289.7535 98.30511
290.2356 100.8910
290.7177 103.5408
291.1998 106.1380
291.6819 108.2684
292.1641 109.5852
292.6462 110.9257
293.1283 113.6584
293.6104 117.5728
294.0925 120.6069
294.5746 121.1885
295.0568 120.4587
295.5389 120.6900
296.0210 122.2587
296.5031 124.4490
296.9852 126.7416
297.4673 129.1643
297.9495 131.8911
298.4316 135.7305
298.9137 139.6138
299.3958 141.4952
299.8779 140.8652
300.3600 140.5219
300.8422 142.7491
301.3243 146.4850
301.8064 150.0033
302.2885 152.8908
302.7706 155.4742
303.2527 158.1024
303.7349 160.7850
304.2170 163.4514
304.6991 166.0126
305.1812 168.5701
305.6633 171.4138
306.1454 174.8820
306.6276 177.8836
307.1097 179.3390
307.5918 179.3164
308.0739 178.9176
308.5560 178.4677
309.0381 177.8122
309.5203 176.7764
310.0024 175.3498
310.4845 174.0519
310.9666 173.3524
311.4487 173.0281
311.9308 172.1664
312.4130 170.4089
312.8951 168.2314
313.3772 166.1119
313.8593 164.0359
314.3414 161.9952
314.8235 160.1443
315.3057 158.3121
315.7878 155.9856
316.2699 153.1392
316.7520 149.7543
317.2341 145.3926
317.7162 140.4617
318.1984 135.8477
318.6805 131.8281
319.1626 128.4029
319.6447 125.7492
320.1268 124.0197
320.6089 122.1183
321.0911 119.3510
321.5732 116.1182
322.0553 112.9074
322.5374 109.7367
323.0195 106.5162
323.5016 103.3735
323.9838 100.3462
324.4659 97.12726
324.9480 93.35928
325.4301 89.39969
325.9122 85.73257
326.3943 82.36542
326.8765 79.39713
327.3586 77.11212
327.8407 75.43289
328.3228 73.54376
328.8049 70.96298
329.2870 68.44800
329.7692 66.82172
330.2513 65.97806
330.7334 65.19168
331.2155 63.94693
331.6976 62.56339
332.1797 61.92191
332.6619 62.39316
333.1440 63.06918
333.6261 62.67386
334.1082 61.72159
334.5903 61.75681
335.0724 64.09015
335.5546 67.35703
336.0367 69.79282
336.5188 71.32816
337.0009 72.56171
337.4830 73.82047
337.9651 74.99268
338.4473 75.86545
338.9294 76.34927
339.4115 76.64883
339.8936 76.87167
340.3757 77.02490
340.8578 77.23352
341.3400 77.65506
341.8221 78.02612
342.3042 77.98996
342.7863 77.52994
343.2684 76.80191
343.7505 75.75204
344.2327 74.49301
344.7148 73.31833
345.1969 72.32596
345.6790 71.32849
346.1611 69.92807
346.6432 68.20694
347.1254 66.90741
347.6075 66.61411
348.0896 66.65808
348.5717 66.15549
349.0538 65.00546
349.5359 63.89825
350.0181 63.36029
350.5002 63.30130
350.9823 63.20248
351.4644 63.04468
351.9465 62.84048
352.4286 62.69687
352.9108 62.55463
353.3929 62.02206
353.8750 60.72540
354.3571 59.11899
354.8392 58.36557
355.3214 58.77469
355.8035 59.18820
356.2856 59.55624
356.7677 59.59067
357.2498 58.76178
357.7319 56.89871
358.2141 54.22165
358.6962 50.71707
359.1783 46.15430
359.6604 42.24438
360.1425 39.60757
360.6246 37.42078
361.1068 34.97205
361.5889 32.16415
362.0710 29.29904
362.5531 26.61450
363.0352 24.10321
363.5173 21.61215
363.9995 19.24466
364.4816 16.77771
364.9637 13.94797
365.4458 10.92969
365.9279 8.220551
366.4100 6.135010
366.8922 4.406464
367.3743 2.195557
367.8564 1.174072
368.3385 4.052399
368.8206 6.157257
369.3027 7.701721
369.7849 8.801300
370.2670 9.505951
370.7491 10.04449
371.2312 10.72620
371.7133 11.59857
372.1954 12.45737
372.6776 13.42050
373.1597 14.27255
373.6418 15.01633
374.1239 15.56290
374.6060 15.66153
375.0881 15.07144
375.5703 13.81305
376.0524 12.66461
376.5345 11.81335
377.0166 10.84833
377.4987 9.377869
377.9808 7.808105
378.4630 6.812775
378.9451 6.706024
379.4272 7.066406
379.9093 6.859772
380.3914 5.453430
380.8735 4.536102
381.3557 4.667999
381.8378 4.908875
382.3199 4.442108
382.8020 3.230255
383.2841 1.923798
383.7662 1.204681
384.2484 1.090820
384.7305 1.440125
385.2126 2.939941
385.6947 4.259979
386.1768 5.107666
386.6589 5.442841
387.1411 5.225861
387.6232 4.361389
388.1053 3.039185
388.5874 1.904694
389.0695 0.8451540
389.5516 0.2232060
390.0338 0.6415410
390.5159 1.184875
390.9980 0.8948970
391.4801 0.4856870
391.9622 2.185760
392.4443 3.147827
392.9265 3.246429
393.4086 3.821503
393.8907 5.241669
394.3728 7.027313
394.8549 9.152985
395.3370 11.45703
395.8192 13.40973
396.3013 14.50620
396.7834 14.99994
397.2655 15.72153
397.7476 16.74371
398.2297 17.80066
398.7119 18.50446
399.1940 19.23334
399.6761 20.63568
400.1582 23.19705
400.6403 25.74652
401.1224 26.89178
401.6046 26.72980
402.0867 26.81082
402.5688 27.88803
403.0509 29.05740
403.5330 29.14081
404.0151 28.11899
404.4973 27.18207
404.9794 26.81424
405.4615 26.87811
405.9436 27.29398
406.4257 28.11725
406.9078 28.74744
407.3900 28.69159
407.8721 27.98999
408.3542 27.00757
408.8363 25.50674
409.3184 23.96860
409.8005 22.56354
410.2827 21.35580
410.7648 20.65253
411.2469 20.69568
411.7290 21.10330
412.2111 20.90121
412.6932 19.55606
413.1754 18.99213
413.6575 20.32407
414.1396 22.17270
414.6217 22.95538
415.1038 22.46011
415.5859 21.74487
416.0681 21.85651
416.5502 22.87985
417.0323 23.86917
417.5144 24.49500
417.9965 25.42447
418.4786 27.12784
418.9608 29.30823
419.4429 31.36761
419.9250 32.98508
420.4071 34.38788
420.8892 36.20807
421.3713 38.72308
421.8535 41.24478
422.3356 43.85403
422.8177 46.40271
423.2998 48.66626
423.7819 50.66956
424.2640 52.65149
424.7462 54.80133
425.2283 57.06912
425.7104 59.66544
426.1925 63.44537
426.6746 66.72055
427.1567 68.77249
427.6389 70.12442
428.1210 71.50888
428.6031 73.24979
429.0852 75.31375
429.5673 77.63965
430.0494 80.27203
430.5316 83.02518
431.0137 86.23669
431.4958 89.29050
431.9779 91.72482
432.4600 93.56631
432.9421 95.21466
433.4243 96.99619
433.9064 98.84711
434.3885 100.4117
434.8706 101.4305
435.3527 102.8254
435.8348 105.5043
436.3170 108.8710
436.7991 112.0072
437.2812 114.6093
437.7633 116.9858
438.2454 119.5792
438.7275 122.2928
439.2097 124.4789
439.6918 125.8567
440.1739 126.7356
440.6560 127.3021
441.1381 127.4612
441.6202 128.3501
442.1024 130.7501
442.5845 133.7073
443.0666 136.2852
443.5487 138.3708
444.0308 139.7416
444.5129 140.0970
444.9951 139.5917
445.4772 139.5332
445.9593 140.4162
446.4414 141.1597
446.9235 141.3225
447.4056 141.1449
447.8878 141.0123
448.3699 141.0663
448.8520 141.1418
449.3341 141.1340
449.8162 141.7657
450.2983 139.9495
450.7805 134.0518
451.2626 127.5752
451.7447 122.1509
452.2268 117.6932
452.7089 113.4332
453.1910 108.8879
453.6732 104.1268
454.1553 99.48993
454.6374 95.13397
455.1195 90.61371
455.6016 85.79486
456.0837 80.86075
456.5659 75.73773
457.0480 70.48013
457.5301 65.80399
458.0122 62.78766
458.4943 61.37769
458.9764 59.21594
459.4586 55.68622
459.9407 52.21585
460.4228 49.29541
460.9049 46.97668
461.3870 45.41064
461.8691 44.79147
462.3513 44.71109
462.8334 44.53387
463.3155 44.29330
463.7976 44.89532
464.2797 46.79056
464.7618 49.48242
465.2440 52.24039
465.7261 55.03821
466.2082 58.45233
466.6903 62.50452
467.1724 67.38043
467.6545 73.46094
468.1367 80.70996
468.6188 88.55777
469.1009 96.56934
469.5830 104.8237
470.0651 113.9594
470.5472 123.6040
471.0294 134.3537
471.5115 146.3868
471.9936 159.5688
472.4757 174.1606
472.9578 190.0839
473.4399 206.3756
473.9221 221.9035
474.4042 236.5731
474.8863 250.9435
475.3684 265.6734
475.8505 279.5816
476.3326 291.6295
476.8148 302.6373
477.2969 313.7734
477.7790 325.4999
478.2611 338.0449
478.7432 351.7630
479.2253 366.6591
479.7075 382.5912
480.1896 399.5582
480.6717 417.4922
481.1538 436.4062
481.6359 456.2845
482.1180 477.1337
482.6002 498.4419
483.0823 520.7929
483.5644 546.6389
484.0465 576.5391
484.5286 607.5085
485.0107 639.0881
485.4929 670.5643
485.9750 701.3299
486.4571 731.1159
486.9392 760.1586
487.4213 790.2865
487.9034 819.5504
488.3856 844.0128
488.8677 863.4468
489.3498 876.4940
489.8319 882.3332
490.3140 880.0686
490.7961 869.6609
491.2783 849.8932
491.7604 823.3027
492.2425 790.1467
492.7246 751.0483
493.2067 705.8219
493.6888 654.5873
494.1710 600.3447
494.6531 548.2292
495.1352 498.1649
495.6173 450.8736
496.0994 405.6570
496.5815 363.4471
497.0637 324.9380
497.5458 289.9408
498.0279 258.1050
498.5100 229.2462
498.9921 203.1832
499.4742 178.8245
499.9564 155.7639
500.4385 135.6580
500.9206 119.7959
501.4027 105.9507
501.8848 93.05157
502.3669 81.03381
502.8491 70.55228
503.3312 62.39954
503.8133 56.01230
504.2954 49.92419
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