#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-05-24 16:00:35 +0300 (Thu, 24 May 2018) $
#$Revision: 863 $
#$URL: svn://172.16.1.111/rod/cif/1/00/03/1000347.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_1000347
loop_
_publ_author_name
'Nyfeler, D.'
'Armbruster, T.'
'Dixon, R.'
'Bermanec, V.'
_publ_section_title
;
 Nchwaningite, Mn2SiO3(OH)2.H2O, a new pyroxene-related chain silicate
 from the N'chwaning mine, Kalahari manganese field, South Africa
;
_journal_name_full               'American Mineralogist'
_journal_page_first              377
_journal_page_last               386
_journal_volume                  80
_journal_year                    1995
_chemical_compound_source        R140275
_chemical_formula_sum            'H4 Mn2 O6 Si'
_chemical_name_mineral           Nchwaningite
_space_group_IT_number           29
_symmetry_space_group_name_Hall  'P 2c -2ac'
_symmetry_space_group_name_H-M   'P c a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.672
_cell_length_b                   7.217
_cell_length_c                   5.341
_cell_volume                     488.455
_exptl_crystal_density_diffrn    3.236
_cod_original_formula_sum        'Mn2 Si O6 H4'
_cod_database_code               9001675
_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            R140275.rod
_rod_data_source.block           3500000
_rod_database.code               1000347
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 9001675 COD http://www.crystallography.net/cod/9001675.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
89.78320 0.0000000E+00
90.26532 2.1698000E-02
90.74744 0.1284640
91.22955 4.954849
91.71167 11.10213
92.19379 15.00951
92.67590 16.67547
93.15802 16.75581
93.64014 14.14879
94.12225 9.987183
94.60437 7.678001
95.08649 9.115746
95.56860 12.42912
96.05072 13.48803
96.53284 12.77433
97.01495 10.46265
97.49707 7.925636
97.97919 5.688507
98.46130 4.326439
98.94342 4.021812
99.42554 4.670158
99.90765 5.086052
100.3898 5.382202
100.8719 5.302673
101.3540 4.260971
101.8361 1.916374
102.3182 0.1041870
102.8004 1.196106
103.2825 1.226357
103.7646 1.046822
104.2467 0.8597720
104.7288 0.3987120
105.2109 0.9989470
105.6931 3.529503
106.1752 6.643326
106.6573 10.27953
107.1394 15.76203
107.6215 19.57243
108.1036 21.68718
108.5858 22.17555
109.0679 21.09395
109.5500 16.88747
110.0321 12.29566
110.5142 8.799248
110.9963 6.596687
111.4785 5.196953
111.9606 4.812698
112.4427 5.393990
112.9248 5.911705
113.4069 5.773537
113.8890 5.728737
114.3712 6.384682
114.8533 8.542343
115.3354 10.77958
115.8175 12.70263
116.2996 14.32250
116.7817 15.64020
117.2639 16.62317
117.7460 17.34113
118.2281 17.88055
118.7102 18.22771
119.1923 18.44191
119.6744 18.36228
120.1566 17.79756
120.6387 17.74542
121.1208 18.89030
121.6029 20.98601
122.0850 23.53875
122.5671 26.74498
123.0493 30.08235
123.5314 33.29272
124.0135 36.76553
124.4956 39.02818
124.9777 37.86971
125.4598 33.97765
125.9420 29.96429
126.4241 27.19115
126.9062 25.49130
127.3883 24.57608
127.8704 24.41922
128.3525 24.97299
128.8347 26.56445
129.3168 29.13689
129.7989 31.51041
130.2810 32.40358
130.7631 32.19955
131.2452 32.58044
131.7274 34.28870
132.2095 36.70444
132.6916 37.94809
133.1737 37.87502
133.6558 37.71581
134.1379 38.35568
134.6201 39.80424
135.1022 42.71303
135.5843 47.67551
136.0664 54.40703
136.5485 60.81531
137.0306 67.14604
137.5128 72.62512
137.9949 76.62184
138.4770 79.18588
138.9591 80.00459
139.4412 78.73732
139.9233 75.27516
140.4055 71.19884
140.8876 66.17386
141.3697 60.85172
141.8518 56.18735
142.3339 52.11914
142.8160 48.87231
143.2982 46.56244
143.7803 45.30907
144.2624 44.75455
144.7445 45.38383
145.2266 46.55936
145.7087 46.76443
146.1909 45.50620
146.6730 43.91867
147.1551 42.41048
147.6372 40.97173
148.1193 39.66483
148.6014 38.34926
149.0836 37.16902
149.5657 36.56833
150.0478 36.32323
150.5299 36.84003
151.0120 38.31485
151.4941 41.53545
151.9763 44.75061
152.4584 48.34587
152.9405 52.07643
153.4226 54.80748
153.9047 56.79269
154.3868 57.52400
154.8690 56.73085
155.3511 54.18494
155.8332 50.33263
156.3153 44.46625
156.7974 36.90686
157.2795 30.16006
157.7617 24.90561
158.2438 20.57614
158.7259 16.76102
159.2080 13.28677
159.6901 10.37413
160.1722 8.223618
160.6544 6.799744
161.1365 5.505936
161.6186 3.770416
162.1007 2.221695
162.5828 1.424210
163.0649 2.547806
163.5471 3.644958
164.0292 3.629013
164.5113 2.460892
164.9934 1.415207
165.4755 1.313446
165.9576 1.647598
166.4398 1.788025
166.9219 1.245041
167.4040 0.6039280
167.8861 0.2315830
168.3682 0.1491700
168.8503 0.2400050
169.3325 0.3935700
169.8146 0.6783140
170.2967 1.196686
170.7788 2.371155
171.2609 3.599411
171.7430 4.112534
172.2252 3.763504
172.7073 3.655151
173.1894 4.933945
173.6715 7.151672
174.1536 9.242615
174.6357 10.36726
175.1179 11.25523
175.6000 12.77437
176.0821 14.99799
176.5642 17.73779
177.0463 21.24855
177.5284 25.24155
178.0106 28.76990
178.4927 31.43059
178.9748 33.29659
179.4569 34.37280
179.9390 34.62387
180.4211 34.28442
180.9033 33.64082
181.3854 32.65744
181.8675 31.19308
182.3496 28.94896
182.8317 26.17935
183.3138 23.34526
183.7960 20.49796
184.2781 17.65302
184.7602 14.79243
185.2423 11.92261
185.7244 9.318710
186.2065 7.042587
186.6887 5.132507
187.1708 3.756256
187.6529 3.025864
188.1350 2.635498
188.6171 1.995575
189.0992 1.115280
189.5814 0.5084230
190.0635 0.6247860
190.5456 1.372055
191.0277 2.086655
191.5098 2.692642
191.9919 3.243820
192.4741 3.745712
192.9562 4.183075
193.4383 4.875031
193.9204 6.149231
194.4025 7.956436
194.8846 9.580063
195.3668 10.93806
195.8489 12.11209
196.3310 13.26500
196.8131 14.38364
197.2952 15.33913
197.7773 16.09888
198.2595 16.66191
198.7416 16.88426
199.2237 16.61806
199.7058 16.14908
200.1879 16.26367
200.6700 17.03302
201.1522 17.94493
201.6343 18.63080
202.1164 19.04994
202.5985 19.59961
203.0806 20.32704
203.5627 21.26335
204.0449 22.42455
204.5270 23.79651
205.0091 25.43655
205.4912 27.40958
205.9733 29.74319
206.4554 32.23450
206.9376 34.85289
207.4197 37.60655
207.9018 40.56110
208.3839 43.60979
208.8660 47.15251
209.3481 51.46745
209.8303 56.67307
210.3124 62.27577
210.7945 68.44295
211.2766 74.91676
211.7587 80.85979
212.2408 86.19966
212.7230 91.19112
213.2051 96.24278
213.6872 101.7483
214.1693 105.9917
214.6514 108.8589
215.1335 110.3009
215.6157 109.8621
216.0978 107.0932
216.5799 103.2482
217.0620 99.01706
217.5441 94.28024
218.0262 89.41483
218.5084 84.24240
218.9905 78.89560
219.4726 74.32779
219.9547 70.65984
220.4368 67.44395
220.9189 64.43260
221.4011 61.54906
221.8832 59.01169
222.3653 56.78502
222.8474 54.91643
223.3295 53.54149
223.8116 52.78224
224.2938 52.36667
224.7759 52.18158
225.2580 52.34663
225.7401 52.45894
226.2222 52.52931
226.7043 52.52429
227.1865 52.38016
227.6686 52.38866
228.1507 51.82495
228.6328 50.11942
229.1149 46.54518
229.5970 43.57787
230.0792 41.63379
230.5613 40.40749
231.0434 38.72372
231.5255 36.29305
232.0076 33.86935
232.4897 31.92688
232.9719 30.78804
233.4540 29.39180
233.9361 27.47929
234.4182 25.29138
234.9003 23.67685
235.3824 22.94078
235.8646 22.34045
236.3467 21.47403
236.8288 20.06140
237.3109 19.02252
237.7930 18.55434
238.2751 18.44119
238.7573 18.00423
239.2394 16.92056
239.7215 15.97020
240.2036 15.56532
240.6857 16.14365
241.1678 16.25128
241.6500 15.70409
242.1321 14.73622
242.6142 13.92252
243.0963 13.29901
243.5784 12.78561
244.0605 12.40787
244.5427 12.36160
245.0248 11.92502
245.5069 10.92612
245.9890 9.603790
246.4711 8.519272
246.9532 7.851212
247.4354 7.114410
247.9175 6.106171
248.3996 4.703262
248.8817 3.413986
249.3638 2.225464
249.8459 1.161270
250.3281 0.2634120
250.8102 0.4635770
251.2923 1.025864
251.7744 1.379272
252.2565 1.425568
252.7386 1.691193
253.2208 2.358948
253.7029 3.111038
254.1850 3.434753
254.6671 3.155334
255.1492 2.786758
255.6313 2.445145
256.1135 2.108704
256.5956 2.003464
257.0777 2.296021
257.5598 2.667160
258.0419 2.680603
258.5240 2.251129
259.0062 1.659378
259.4883 0.9230040
259.9704 3.7872002E-02
260.4525 0.6996770
260.9346 1.197952
261.4167 1.652344
261.8989 2.310898
262.3810 3.261963
262.8631 4.160477
263.3452 4.845108
263.8273 5.331650
264.3094 6.183929
264.7916 7.485931
265.2737 9.045044
265.7558 10.66675
266.2379 12.25929
266.7200 14.21472
267.2021 16.75618
267.6843 19.79391
268.1664 22.51784
268.6485 24.82166
269.1306 27.01958
269.6127 29.33328
270.0948 31.76117
270.5770 34.27711
271.0591 36.91212
271.5412 39.60034
272.0233 42.03098
272.5054 44.01720
272.9875 46.14148
273.4697 48.87210
273.9518 52.32976
274.4339 55.72478
274.9160 58.85622
275.3981 61.91580
275.8802 65.49902
276.3624 69.51814
276.8445 74.21274
277.3266 79.93269
277.8087 86.75717
278.2908 93.43726
278.7729 99.81189
279.2551 106.0597
279.7372 112.6965
280.2193 119.9308
280.7014 126.3324
281.1835 131.2495
281.6656 134.6868
282.1478 136.9083
282.6299 137.8634
283.1120 137.7280
283.5941 136.6845
284.0762 134.7082
284.5583 132.1401
285.0405 128.7642
285.5226 124.7231
286.0047 121.3753
286.4868 118.7945
286.9689 116.6844
287.4510 114.6225
287.9332 112.6228
288.4153 110.9628
288.8974 109.5865
289.3795 108.6373
289.8616 108.8364
290.3438 110.2563
290.8259 112.4032
291.3080 114.9541
291.7901 117.7958
292.2722 120.4608
292.7543 122.5676
293.2365 124.4952
293.7186 127.2749
294.2007 130.9072
294.6828 134.4489
295.1649 136.9450
295.6470 138.6133
296.1292 140.2906
296.6113 142.2981
297.0934 144.2581
297.5755 145.6453
298.0576 146.4737
298.5397 146.8292
299.0219 146.8418
299.5040 146.4219
299.9861 145.3182
300.4682 143.3800
300.9503 141.0367
301.4324 138.8069
301.9146 136.6002
302.3967 133.9598
302.8788 130.5573
303.3609 126.5943
303.8430 122.3332
304.3251 117.7052
304.8073 113.2244
305.2894 109.1482
305.7715 105.5534
306.2536 102.5140
306.7357 100.4325
307.2178 98.76448
307.7000 96.95100
308.1821 94.91516
308.6642 92.98886
309.1463 91.73550
309.6284 90.73064
310.1105 89.29634
310.5927 86.45247
311.0748 83.54997
311.5569 81.70764
312.0390 80.96561
312.5211 80.18192
313.0032 78.79286
313.4854 76.97694
313.9675 74.93961
314.4496 72.78105
314.9317 70.35895
315.4138 67.53482
315.8959 64.37361
316.3781 61.09174
316.8602 57.44313
317.3423 53.94980
317.8244 51.01624
318.3065 48.90466
318.7886 47.04317
319.2708 45.41502
319.7529 43.93364
320.2350 42.34984
320.7171 40.17337
321.1992 38.20430
321.6813 36.93463
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322.6456 36.48717
323.1277 35.21587
323.6098 33.55020
324.0919 32.34996
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325.0562 32.29170
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327.4667 24.22610
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329.3952 20.54056
329.8773 19.06874
330.3594 17.76906
330.8416 16.69319
331.3237 15.76004
331.8058 14.91469
332.2879 14.12476
332.7700 13.47513
333.2521 12.98840
333.7343 12.64227
334.2164 12.33543
334.6985 12.07251
335.1806 11.84169
335.6627 11.64625
336.1448 11.51233
336.6270 11.30917
337.1091 10.94493
337.5912 10.57895
338.0733 10.58946
338.5554 11.09506
339.0375 11.60176
339.5197 12.00923
340.0018 12.33739
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340.9660 11.02715
341.4481 9.726822
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342.4124 8.326538
342.8945 7.830246
343.3766 7.173737
343.8587 6.413498
344.3408 5.802628
344.8229 5.361801
345.3051 4.948181
345.7872 4.497604
346.2693 3.991074
346.7514 3.232727
347.2335 2.077042
347.7156 0.7974090
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348.6799 0.6990510
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350.6083 0.7175600
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364.5897 4.405029
365.0718 4.209808
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366.0361 5.955612
366.5182 7.785995
367.0003 8.911209
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368.4467 8.020615
368.9288 8.320801
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370.3751 11.86406
370.8572 13.33066
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380.4996 30.97339
380.9817 29.81340
381.4638 27.80247
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382.4280 26.09152
382.9102 26.36452
383.3923 26.38452
383.8744 26.17081
384.3565 25.92831
384.8386 25.85127
385.3207 25.82866
385.8029 25.68748
386.2850 25.43788
386.7671 24.91051
387.2492 23.64188
387.7313 21.94717
388.2134 20.56932
388.6956 19.79851
389.1777 19.54065
389.6598 20.15701
390.1419 21.55473
390.6240 22.26939
391.1061 20.79631
391.5883 18.44305
392.0704 16.56544
392.5525 15.62379
393.0346 15.10666
393.5167 15.01137
393.9988 15.17842
394.4810 15.15692
394.9631 14.52216
395.4452 13.86824
395.9273 13.47675
396.4094 13.39444
396.8915 13.52773
397.3737 14.04797
397.8558 14.71057
398.3379 15.21401
398.8200 15.42458
399.3021 15.57597
399.7842 15.58803
400.2664 15.46091
400.7485 15.75465
401.2306 16.72681
401.7127 17.85939
402.1948 18.82404
402.6769 19.53152
403.1591 20.24522
403.6412 20.91989
404.1233 21.63306
404.6054 22.72917
405.0875 24.46494
405.5696 25.77812
406.0518 25.89575
406.5339 24.76335
407.0160 24.82428
407.4981 26.35921
407.9802 28.46742
408.4623 30.08379
408.9445 31.21658
409.4266 32.26862
409.9087 33.36612
410.3908 34.42947
410.8729 35.31866
411.3550 36.02702
411.8372 36.44899
412.3193 36.43307
412.8014 36.08710
413.2835 35.60951
413.7656 34.97559
414.2477 34.30969
414.7299 33.74951
415.2120 33.31050
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