#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 14:01:37 +0300 (Thu, 26 Apr 2018) $
#$Revision: 610 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000149.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_1000149
loop_
_publ_author_name
'Kampf, A. R.'
'Mills, S. J.'
'Nestola, F.'
'Ciriotti, M. E.'
'Kasatkin, A. V.'
_publ_section_title
;
 Saltonseaite, K3NaMn2+Cl6, the Mn analogue of rinneite from the Salton
 Sea, California
;
_journal_name_full               'American Mineralogist'
_journal_page_first              231
_journal_page_last               235
_journal_paper_doi               10.2138/am.2013.4214
_journal_volume                  98
_journal_year                    2012
_chemical_compound_source        'Salton Sea, California, USA'
_chemical_formula_sum            'Cl6 K3 Mn Na'
_chemical_name_mineral           Saltonseaite
_space_group_IT_number           167
_symmetry_space_group_name_Hall  '-R 3 2"c'
_symmetry_space_group_name_H-M   'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   12.0966
_cell_length_b                   12.0966
_cell_length_c                   13.9555
_cell_volume                     1768.490
_exptl_crystal_density_diffrn    2.298
_cod_original_sg_symbol_H-M      'R -3 c'
_cod_original_formula_sum        'K3 Na Mn Cl6'
_cod_database_code               9014382
_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            R120131.rod
_rod_data_source.block           3500000
_rod_database.code               1000149
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 9014382 COD http://www.crystallography.net/cod/9014382.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
98.91344 0.0000000E+00
99.39556 1.387520
99.87768 4.047211
100.3598 6.871864
100.8419 9.299736
101.3240 11.27425
101.8061 13.34098
102.2883 15.22527
102.7704 16.45920
103.2525 17.30595
103.7346 17.72184
104.2167 18.41456
104.6988 18.60471
105.1810 16.97076
105.6631 14.10062
106.1452 10.56617
106.6273 6.878609
107.1094 4.017441
107.5915 2.311325
108.0737 1.130661
108.5558 0.2297820
109.0379 0.4177780
109.5200 0.8244170
110.0021 1.049454
110.4842 1.163536
110.9664 0.6927950
111.4485 0.5541610
111.9306 2.163101
112.4127 4.031235
112.8948 6.099106
113.3769 8.323166
113.8591 10.62025
114.3412 13.03796
114.8233 15.49881
115.3054 18.48506
115.7875 21.31416
116.2696 23.30479
116.7517 24.20967
117.2339 24.28482
117.7160 24.00468
118.1981 23.32573
118.6802 22.49828
119.1623 21.52461
119.6444 20.44544
120.1266 19.34297
120.6087 18.19138
121.0908 17.10904
121.5729 16.28850
122.0550 15.83196
122.5371 15.46009
123.0193 14.85313
123.5014 13.95408
123.9835 13.30041
124.4656 13.28153
124.9477 13.60334
125.4298 14.02361
125.9120 14.40160
126.3941 14.90172
126.8762 15.95245
127.3583 17.95136
127.8404 19.86617
128.3225 21.32195
128.8047 22.53943
129.2868 23.80985
129.7689 25.32845
130.2510 27.07364
130.7331 28.72935
131.2152 29.73117
131.6974 31.20267
132.1795 33.60191
132.6616 36.74448
133.1437 40.12779
133.6258 43.32468
134.1079 46.29430
134.5901 49.45845
135.0722 52.78812
135.5543 56.29263
136.0364 60.13927
136.5185 64.27597
137.0006 68.31770
137.4828 71.83141
137.9649 74.79476
138.4470 77.07059
138.9291 78.42085
139.4112 79.17669
139.8933 79.60558
140.3755 79.68850
140.8576 79.73768
141.3397 80.15375
141.8218 80.89069
142.3039 81.79344
142.7860 82.62418
143.2681 83.52792
143.7503 85.01735
144.2324 87.17966
144.7145 90.10081
145.1966 93.76705
145.6787 98.16758
146.1608 103.0063
146.6430 108.0220
147.1251 113.1979
147.6072 118.7729
148.0893 124.9394
148.5714 131.5505
149.0535 138.5934
149.5357 146.0055
150.0178 153.8079
150.4999 162.0913
150.9820 171.0924
151.4641 180.3727
151.9462 190.1164
152.4284 199.9691
152.9105 209.9660
153.3926 220.0234
153.8747 229.7242
154.3568 237.9921
154.8389 244.3937
155.3211 249.5352
155.8032 253.8832
156.2853 256.9077
156.7674 258.0557
157.2495 256.9239
157.7316 253.6063
158.2138 248.2508
158.6959 239.6487
159.1780 230.7057
159.6601 221.8678
160.1422 213.1970
160.6243 204.6947
161.1065 196.2868
161.5886 188.1943
162.0707 181.2865
162.5528 176.1208
163.0349 171.5057
163.5170 167.1925
163.9991 163.0965
164.4813 158.4518
164.9634 152.9350
165.4455 146.3878
165.9276 138.6477
166.4097 129.1905
166.8918 118.8567
167.3740 108.3830
167.8561 97.64829
168.3382 87.50715
168.8203 78.55138
169.3024 70.57463
169.7845 63.38059
170.2667 57.03638
170.7488 51.39258
171.2309 46.07973
171.7130 40.90974
172.1951 36.49771
172.6772 33.11521
173.1594 30.44618
173.6415 28.03011
174.1236 25.59117
174.6057 23.19408
175.0878 21.28249
175.5699 20.20595
176.0521 19.27840
176.5342 18.33797
177.0163 17.40851
177.4984 16.55686
177.9805 15.81371
178.4626 15.17703
178.9448 14.77557
179.4269 14.94408
179.9090 15.01736
180.3911 14.65462
180.8732 14.00177
181.3553 13.46717
181.8375 13.41920
182.3196 13.92468
182.8017 14.27430
183.2838 14.56196
183.7659 14.65693
184.2480 14.40780
184.7301 13.86158
185.2123 13.25797
185.6944 12.84349
186.1765 12.66017
186.6586 12.21275
187.1407 11.40778
187.6228 10.42658
188.1050 9.287102
188.5871 8.016045
189.0692 6.878071
189.5513 6.215523
190.0334 6.017899
190.5155 5.664059
190.9977 5.006378
191.4798 4.202629
191.9619 3.384937
192.4440 2.548439
192.9261 1.795326
193.4082 1.257668
193.8904 0.8872830
194.3725 0.5941090
194.8546 0.3989140
195.3367 0.2537230
195.8188 5.2593000E-02
196.3009 0.2404520
196.7831 0.5278020
197.2652 0.7241250
197.7473 0.8589970
198.2294 0.9981540
198.7115 1.237617
199.1936 1.527008
199.6758 1.633148
200.1579 1.456905
200.6400 1.215466
201.1221 0.9967120
201.6042 0.8096350
202.0863 0.6762960
202.5685 0.6772000
203.0506 0.7937280
203.5327 0.6849780
204.0148 0.1457980
204.4969 0.4250530
204.9790 0.8688770
205.4612 1.216667
205.9433 1.569645
206.4254 2.015034
206.9075 2.559315
207.3896 3.076679
207.8717 3.442219
208.3539 3.896900
208.8360 4.527321
209.3181 5.317471
209.8002 6.216667
210.2823 7.209656
210.7644 8.324284
211.2466 9.233418
211.7287 9.520348
212.2108 10.00185
212.6929 11.07950
213.1750 12.67447
213.6571 14.45423
214.1393 16.12340
214.6214 17.66477
215.1035 19.21907
215.5856 20.70772
216.0677 22.27624
216.5498 23.98859
217.0320 25.85376
217.5141 27.90813
217.9962 30.17254
218.4783 32.66398
218.9604 34.97198
219.4425 36.86998
219.9247 38.78980
220.4068 40.97856
220.8889 43.46760
221.3710 46.19179
221.8531 49.10717
222.3352 52.20508
222.8174 55.26637
223.2995 57.94616
223.7816 60.87072
224.2637 64.61407
224.7458 69.17302
225.2279 73.89732
225.7100 78.25552
226.1922 82.30345
226.6743 86.59347
227.1564 91.19118
227.6385 95.99338
228.1206 100.8907
228.6027 105.8753
229.0849 110.9765
229.5670 116.2923
230.0491 121.7001
230.5312 126.9159
231.0133 132.2799
231.4954 137.2004
231.9776 141.1137
232.4597 144.0407
232.9418 145.8205
233.4239 146.0637
233.9060 145.0897
234.3881 143.2040
234.8703 140.3819
235.3524 136.7604
235.8345 132.5109
236.3166 127.6173
236.7987 122.0354
237.2808 115.0406
237.7630 107.5175
238.2451 100.3690
238.7272 93.89862
239.2093 87.87452
239.6914 81.96858
240.1735 76.10883
240.6557 70.53842
241.1378 65.37446
241.6199 60.49490
242.1020 55.79208
242.5841 51.20963
243.0662 46.90290
243.5484 43.15927
244.0305 40.07622
244.5126 37.33447
244.9947 34.97852
245.4768 32.83290
245.9589 30.75085
246.4410 28.67511
246.9232 26.68819
247.4053 24.92221
247.8874 23.47450
248.3695 22.03531
248.8516 20.43012
249.3337 18.88018
249.8159 17.60688
250.2980 16.66834
250.7801 15.88108
251.2622 14.91152
251.7443 13.64287
252.2264 12.46625
252.7086 11.38890
253.1907 10.41696
253.6728 9.535389
254.1549 8.743168
254.6370 8.066174
255.1191 7.558315
255.6013 7.290546
256.0834 7.063911
256.5655 7.030449
257.0476 6.905931
257.5297 6.425482
258.0118 5.602074
258.4940 4.730427
258.9761 4.228197
259.4582 4.313953
259.9403 4.209881
260.4224 3.782076
260.9045 3.293205
261.3867 2.893473
261.8688 2.623732
262.3509 2.444405
262.8330 2.329746
263.3151 2.315109
263.7972 2.232468
264.2794 2.057760
264.7615 1.850536
265.2436 1.629501
265.7257 1.404564
266.2078 1.186916
266.6899 0.9858170
267.1721 0.8015710
267.6542 0.6461720
268.1363 0.4984110
268.6184 0.3918420
269.1005 0.3639220
269.5826 0.3987450
270.0648 0.4406050
270.5469 0.4412670
271.0290 0.3987430
271.5111 0.3952160
271.9932 0.4861350
272.4753 0.5527060
272.9575 0.5711690
273.4396 0.5273490
273.9217 0.3751070
274.4038 5.7110000E-02
274.8859 0.3994870
275.3680 0.6347500
275.8501 0.5613330
276.3322 0.4238640
276.8144 0.2229420
277.2965 1.8114001E-02
277.7786 4.4675998E-02
278.2607 0.1405680
278.7428 0.4895400
279.2249 0.6293220
279.7071 0.3687650
280.1892 0.1676290
280.6713 0.1902030
281.1534 0.3424720
281.6355 0.4596460
282.1176 0.4701140
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283.0819 0.3730700
283.5640 0.4106120
284.0461 0.3731780
284.5282 0.1326500
285.0103 0.1766550
285.4925 0.3374400
285.9746 0.2676700
286.4567 9.6083000E-02
286.9388 3.5973001E-02
287.4209 0.1090410
287.9030 0.2089390
288.3852 0.3675140
288.8673 0.5261140
289.3494 0.6027300
289.8315 0.5767440
290.3136 0.5110070
290.7957 0.4825120
291.2779 0.4997200
291.7600 0.4835870
292.2421 0.4022080
292.7242 0.2980000
293.2063 0.1798310
293.6884 5.1491000E-02
294.1706 5.6400001E-03
294.6527 0.1621280
295.1348 0.5240380
295.6169 0.7937150
296.0990 0.9988780
296.5811 1.082129
297.0633 0.9008010
297.5454 0.4858470
298.0275 0.1610950
298.5096 0.1845070
298.9917 0.5081790
299.4738 0.7252830
299.9560 0.7300760
300.4381 0.7273580
300.9202 0.8857080
301.4023 1.158867
301.8844 1.325043
302.3665 1.237820
302.8487 1.000990
303.3308 0.9372580
303.8129 1.163645
304.2950 1.353851
304.7771 1.298813
305.2592 1.092384
305.7414 0.9961700
306.2235 1.139252
306.7056 1.381863
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314.4195 1.110880
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317.7943 1.219025
318.2764 1.433733
318.7585 1.592211
319.2406 1.699549
319.7227 1.798937
320.2048 1.953171
320.6870 2.038063
321.1691 1.944021
321.6512 1.713522
322.1333 1.478439
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366.0059 7.9095997E-02
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370.3449 4.7848001E-02
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386.7369 0.6712140
387.2190 0.5432730
387.7011 0.2738450
388.1833 7.7799999E-04
388.6654 5.1583000E-02
389.1475 0.2479130
389.6296 0.6392470
390.1117 0.9390900
390.5938 1.142190
391.0760 1.191605
391.5581 1.023116
392.0402 0.7641700
392.5223 0.5772090
393.0044 0.4583770
393.4865 0.4012650
393.9687 0.4652120
394.4508 0.5719670
394.9329 0.5757650
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396.3792 0.2598700
396.8614 0.3098770
397.3435 0.3769750
397.8256 0.4925610
398.3077 0.5957240
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399.7540 0.6195660
400.2361 0.7086460
400.7183 0.8295590
401.2004 0.8361970
401.6825 0.6737980
402.1646 0.5164080
402.6467 0.3815980
403.1288 0.2714430
403.6110 0.1877420
404.0931 0.1318990
404.5752 0.1071380
405.0573 0.1146550
405.5394 0.1501240
406.0215 0.2548270
406.5037 0.5306620
406.9858 0.7717410
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407.9500 0.8418840
408.4321 0.7792110
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410.8427 0.5755650
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411.8069 0.4763330
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