#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 13:28:04 +0300 (Thu, 26 Apr 2018) $
#$Revision: 468 $
#$URL: svn://172.16.1.111/rod/cif/2/10/00/2100004.rod $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2100004
loop_
_publ_author_name
'Okada, K.'
'Ossaka, J.'
_publ_section_title
;
 Structures of potassium sodium sulphate and tripotassium sodium
 disulphate
;
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              919
_journal_page_last               921
_journal_paper_doi               10.1107/S0567740880004852
_journal_volume                  36
_journal_year                    1980
_chemical_compound_source        R050651
_chemical_formula_sum            'K3 Na O8 S2'
_chemical_name_mineral           Aphthitalite
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   5.6801
_cell_length_b                   5.6801
_cell_length_c                   7.309
_cell_volume                     204.221
_exptl_crystal_density_diffrn    2.703
_cod_original_formula_sum        'K3 Na S2 O8'
_cod_database_code               9007639
_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            R050651.rod
_rod_data_source.block           3500000
_rod_database.code               2100004
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 9007639 COD http://www.crystallography.net/cod/9007639.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
151.8078 0.0000000E+00
152.2899 1.855469
152.7720 0.3486330
153.2542 0.6049800
153.7363 6.909424
154.2184 16.88989
154.7005 28.37061
155.1826 40.21606
155.6647 52.35522
156.1469 64.58936
156.6290 75.71460
157.1111 88.10254
157.5932 103.3015
158.0753 120.3274
158.5574 137.0320
159.0396 151.6389
159.5217 163.7285
160.0038 176.3958
160.4859 191.3450
160.9680 205.1536
161.4501 217.3406
161.9323 228.0459
162.4144 236.4788
162.8965 242.0554
163.3786 245.1099
163.8607 242.3577
164.3428 231.2034
164.8250 216.1284
165.3071 199.0278
165.7892 180.4380
166.2713 161.2612
166.7534 145.1840
167.2355 132.8568
167.7177 119.8971
168.1998 104.4198
168.6819 89.50757
169.1640 77.92139
169.6461 70.12732
170.1282 64.25281
170.6104 57.34277
171.0925 49.39282
171.5746 41.18823
172.0567 34.98218
172.5388 31.23523
173.0209 28.37097
173.5031 25.62793
173.9852 24.26758
174.4673 21.92908
174.9494 17.67102
175.4315 13.87817
175.9136 13.50354
176.3958 16.42920
176.8779 17.49585
177.3600 14.94629
177.8421 11.49768
178.3242 7.749512
178.8063 4.381104
179.2885 1.841797
179.7706 1.209106
180.2527 2.785767
180.7348 3.384766
181.2169 2.537476
181.6990 1.436646
182.1812 0.8289790
182.6633 0.7758790
183.1454 0.8171390
183.6275 0.5664060
184.1096 9.4237998E-02
184.5917 0.7343750
185.0738 1.926636
185.5560 2.958740
186.0381 2.624390
186.5202 0.5538330
187.0023 2.116943
187.4844 3.663574
187.9665 3.687012
188.4487 2.975708
188.9308 0.6224370
189.4129 1.840210
189.8950 2.925293
190.3771 2.072510
190.8592 0.2585450
191.3414 0.5441890
191.8235 9.2041001E-02
192.3056 0.9329830
192.7877 2.474854
193.2698 3.971436
193.7519 4.117554
194.2341 2.239258
194.7162 0.3640140
195.1983 0.7082520
195.6804 1.814209
196.1625 3.813843
196.6446 4.169678
197.1268 3.271240
197.6089 1.869873
198.0910 3.6377002E-02
198.5731 1.952271
199.0552 3.110107
199.5373 3.471924
200.0195 3.504761
200.5016 3.564087
200.9837 3.553101
201.4658 2.884766
201.9479 0.8530270
202.4300 1.320801
202.9122 2.514404
203.3943 2.733032
203.8764 1.974731
204.3585 0.2005620
204.8406 3.748657
205.3227 7.053833
205.8048 10.91626
206.2870 13.23047
206.7691 11.54712
207.2512 5.724609
207.7333 0.2534180
208.2154 1.563599
208.6975 2.762329
209.1797 5.815186
209.6618 6.615601
210.1439 6.573120
210.6260 7.181641
211.1081 8.714966
211.5902 10.43359
212.0724 11.02795
212.5545 9.470459
213.0366 10.02148
213.5187 14.89331
214.0008 20.39709
214.4829 24.35400
214.9651 26.32837
215.4472 27.31030
215.9293 28.82654
216.4114 31.81873
216.8935 33.23877
217.3756 30.02991
217.8578 27.58276
218.3399 31.22888
218.8220 41.39746
219.3041 52.75159
219.7862 56.80188
220.2683 48.07703
220.7505 42.24292
221.2326 39.75415
221.7147 39.47375
222.1968 40.96375
222.6789 43.96790
223.1610 47.87048
223.6432 51.92969
224.1253 57.34021
224.6074 59.95740
225.0895 57.92468
225.5716 54.17847
226.0537 50.63684
226.5358 47.83923
227.0180 46.72607
227.5001 49.28357
227.9822 57.66980
228.4643 62.64417
228.9464 60.11902
229.4285 55.49365
229.9107 55.38391
230.3928 61.40479
230.8749 68.43567
231.3570 69.14038
231.8391 62.79138
232.3212 58.54028
232.8034 59.73669
233.2855 63.05811
233.7676 64.00879
234.2497 61.52332
234.7318 58.41077
235.2139 57.55713
235.6961 58.69373
236.1782 61.27917
236.6603 67.71069
237.1424 74.75073
237.6245 76.52869
238.1066 71.03784
238.5888 64.90613
239.0709 65.73779
239.5530 71.36487
240.0351 75.05664
240.5172 73.40210
240.9993 68.54968
241.4815 64.26904
241.9636 60.48706
242.4457 58.00061
242.9278 58.08813
243.4099 59.77979
243.8920 61.27185
244.3742 61.94678
244.8563 61.98169
245.3384 61.62744
245.8205 60.72595
246.3026 59.66602
246.7847 58.83374
247.2668 57.87292
247.7490 56.35779
248.2311 53.99927
248.7132 51.22961
249.1953 48.87109
249.6774 47.06921
250.1595 45.10571
250.6417 42.57385
251.1238 39.72998
251.6059 36.91089
252.0880 34.24951
252.5701 31.98450
253.0522 30.44031
253.5344 29.63892
254.0165 29.16821
254.4986 29.55933
254.9807 30.13220
255.4628 29.91040
255.9449 28.36450
256.4271 26.13513
256.9092 25.02527
257.3913 26.16565
257.8734 26.22607
258.3555 23.25952
258.8376 19.71362
259.3198 18.04138
259.8019 19.21265
260.2840 21.88733
260.7661 23.48682
261.2482 23.83545
261.7303 23.54150
262.2125 22.19556
262.6946 20.66321
263.1767 19.56165
263.6588 19.11267
264.1409 19.33325
264.6230 20.44690
265.1052 23.67261
265.5873 25.16150
266.0694 22.85803
266.5515 20.42969
267.0336 20.52393
267.5157 23.64673
267.9979 28.28894
268.4800 32.64136
268.9621 38.31091
269.4442 39.76184
269.9263 33.75781
270.4084 26.75598
270.8906 23.13623
271.3727 23.38440
271.8548 24.92737
272.3369 24.56555
272.8190 21.38391
273.3011 19.37634
273.7833 19.50098
274.2654 19.79358
274.7475 19.05859
275.2296 17.31152
275.7117 15.35400
276.1938 13.91443
276.6760 12.94629
277.1581 13.15381
277.6402 15.56946
278.1223 17.82214
278.6044 18.77502
279.0865 18.58655
279.5686 17.97815
280.0508 17.39429
280.5329 16.81165
281.0150 17.68591
281.4971 22.35400
281.9792 25.81458
282.4613 25.21411
282.9435 21.81104
283.4256 18.66138
283.9077 17.71094
284.3898 18.76062
284.8719 20.22498
285.3540 23.64136
285.8362 25.74939
286.3183 24.68250
286.8004 21.76880
287.2825 19.48230
287.7646 19.16064
288.2467 20.14404
288.7289 20.08411
289.2110 18.09253
289.6931 16.26501
290.1752 15.05396
290.6573 14.17639
291.1394 13.18958
291.6216 11.90552
292.1037 10.62903
292.5858 10.04626
293.0679 10.93628
293.5500 11.04224
294.0321 9.238525
294.5143 6.942139
294.9964 6.044800
295.4785 7.037964
295.9606 8.373047
296.4427 7.607666
296.9248 3.368042
297.4070 1.363037
297.8891 4.209595
298.3712 7.924683
298.8533 8.485718
299.3354 5.449829
299.8175 1.884521
300.2997 0.9754640
300.7818 3.274536
301.2639 4.742676
301.7460 4.518799
302.2281 4.153198
302.7102 5.003540
303.1924 6.938110
303.6745 8.685547
304.1566 9.425049
304.6387 8.844360
305.1208 7.437256
305.6029 3.472656
306.0851 0.7066650
306.5672 1.689819
307.0493 5.676270
307.5314 10.23315
308.0135 14.10583
308.4956 17.17139
308.9778 19.21631
309.4599 19.39331
309.9420 19.65881
310.4241 21.89331
310.9062 24.51538
311.3883 23.88269
311.8705 18.10266
312.3526 10.07959
312.8347 6.652222
313.3168 9.526611
313.7989 12.02271
314.2810 12.58325
314.7632 12.16956
315.2453 11.89124
315.7274 11.96985
316.2095 12.39685
316.6916 13.41028
317.1737 15.31177
317.6559 16.54333
318.1380 16.91833
318.6201 16.59424
319.1022 15.18823
319.5843 12.77808
320.0664 11.00452
320.5485 11.73608
321.0306 15.23279
321.5128 17.05212
321.9949 15.67749
322.4770 13.96997
322.9591 13.91565
323.4412 15.29871
323.9233 16.65588
324.4055 17.11255
324.8876 16.69250
325.3697 15.72888
325.8518 13.11572
326.3339 11.20935
326.8160 10.89661
327.2982 11.93677
327.7803 14.01038
328.2624 17.17419
328.7445 20.78918
329.2266 23.12390
329.7087 23.65845
330.1909 24.08801
330.6730 25.01807
331.1551 25.90015
331.6372 25.68225
332.1193 24.03699
332.6014 22.29626
333.0836 22.64075
333.5657 26.47278
334.0478 28.04053
334.5299 24.46753
335.0120 20.33081
335.4941 20.01941
335.9763 23.74902
336.4584 27.87817
336.9405 28.87317
337.4226 26.35413
337.9047 25.14038
338.3868 26.23108
338.8690 27.50977
339.3511 28.01160
339.8332 27.77600
340.3153 27.23303
340.7974 26.67566
341.2795 26.02307
341.7617 24.76807
342.2438 21.82312
342.7259 19.67383
343.2080 19.18567
343.6901 19.75989
344.1722 20.72400
344.6544 21.82886
345.1365 22.72437
345.6186 22.63770
346.1007 20.08679
346.5828 18.84570
347.0649 20.37024
347.5471 22.38367
348.0292 22.86267
348.5113 21.45679
348.9934 19.07031
349.4755 16.59717
349.9576 13.54529
350.4398 12.67468
350.9219 16.82324
351.4040 20.24426
351.8861 18.90125
352.3682 13.90710
352.8503 9.429199
353.3325 8.803955
353.8146 11.68994
354.2967 12.64844
354.7788 9.449951
355.2609 6.842529
355.7430 6.417847
356.2252 7.055176
356.7073 6.880615
357.1894 4.981934
357.6715 2.328979
358.1536 1.421753
358.6357 4.017456
359.1179 5.796997
359.5999 7.529907
360.0821 7.897217
360.5642 4.585571
361.0463 2.233276
361.5284 8.860352
362.0105 10.32922
362.4926 4.832886
362.9748 1.085205
363.4569 0.8963620
363.9390 1.307617
364.4211 0.7735600
364.9032 4.475708
365.3853 7.798462
365.8675 9.277344
366.3496 9.046997
366.8317 8.257446
367.3138 6.696289
367.7959 4.784790
368.2780 1.987671
368.7602 0.8588870
369.2423 2.727295
369.7244 3.156006
370.2065 2.561279
370.6886 1.668945
371.1707 0.2437740
371.6529 0.7856450
372.1350 1.656372
372.6171 1.895752
373.0992 0.7015380
373.5813 1.813477
374.0634 4.211792
374.5456 4.458008
375.0277 2.364380
375.5098 2.236572
375.9919 5.912964
376.4740 9.751343
376.9561 11.96985
377.4383 13.04175
377.9204 14.18494
378.4025 16.33044
378.8846 18.92126
379.3667 20.13330
379.8488 19.16919
380.3310 18.89734
380.8131 21.07654
381.2952 24.25073
381.7773 27.05713
382.2594 29.15930
382.7415 30.81165
383.2237 32.14404
383.7058 33.16125
384.1879 34.30847
384.6700 35.71680
385.1521 37.28174
385.6342 38.57300
386.1164 39.67114
386.5985 41.70532
387.0806 46.24841
387.5627 52.07556
388.0448 56.41357
388.5269 59.05176
389.0091 60.10999
389.4912 58.01624
389.9733 54.40173
390.4554 53.06018
390.9375 56.26770
391.4196 60.63733
391.9018 63.81714
392.3839 65.73010
392.8660 65.16418
393.3481 60.19641
393.8302 53.76172
394.3123 52.14294
394.7945 57.22144
395.2766 60.57788
395.7587 56.91077
396.2408 49.87549
396.7229 45.86853
397.2050 46.40796
397.6872 48.75842
398.1693 50.62207
398.6514 52.02380
399.1335 50.42664
399.6156 41.92639
400.0977 33.41345
400.5798 30.83728
401.0620 33.14026
401.5441 34.50024
402.0262 31.04016
402.5083 23.99805
402.9904 19.73999
403.4725 20.41907
403.9547 20.75220
404.4368 19.34338
404.9189 17.20190
405.4010 15.52136
405.8831 14.69519
406.3652 14.52795
406.8474 14.82227
407.3295 15.94312
407.8116 16.44678
408.2937 15.76648
408.7758 15.05042
409.2579 14.69434
409.7401 14.85437
410.2222 15.92969
410.7043 18.49146
411.1864 22.10669
411.6685 23.00854
412.1506 18.45361
412.6328 14.41980
413.1149 11.65076
413.5970 9.898560
414.0791 9.098633
414.5612 9.170654
415.0433 9.451538
415.5255 8.803101
416.0076 6.821411
416.4897 5.342163
416.9718 4.956299
417.4539 4.683228
417.9360 4.017456
418.4182 3.022583
418.9003 1.940918
419.3824 0.6533200
419.8645 0.4371340
420.3466 0.2097170
420.8287 1.930542
421.3109 3.629272
421.7930 3.041382
422.2751 1.770142
422.7572 1.792236
423.2393 3.936401
423.7214 6.366699
424.2036 6.872437
424.6857 5.574707
425.1678 4.826050
425.6499 5.183472
426.1320 6.306641
426.6141 8.229248
427.0963 10.66431
427.5784 12.15967
428.0605 11.07739
428.5426 9.107422
429.0247 8.592896
429.5068 9.612183
429.9890 12.18274
430.4711 16.25452
430.9532 22.20898
431.4353 30.17493
431.9174 40.66821
432.3995 52.27686
432.8817 63.95667
433.3638 76.21887
433.8459 90.77234
434.3280 108.3323
434.8101 126.5895
435.2922 142.5730
435.7744 156.1257
436.2565 167.0840
436.7386 175.3552
437.2207 181.0800
437.7028 182.5289
438.1849 181.0078
438.6671 180.8523
439.1492 184.9617
439.6313 192.8716
440.1134 201.8256
440.5955 212.2228
441.0776 223.2502
441.5598 233.5239
442.0418 245.0337
442.5240 260.9889
443.0061 281.6302
443.4882 302.7968
443.9703 318.0944
444.4524 325.0713
444.9345 337.9763
445.4167 359.7886
445.8988 384.6919
446.3809 409.9647
446.8630 436.7875
447.3451 467.9392
447.8272 504.7015
448.3094 546.7938
448.7915 594.5042
449.2736 650.1316
449.7557 704.6713
450.2378 762.4600
450.7199 814.1980
451.2021 858.5869
451.6842 893.7192
452.1663 904.5106
452.6484 876.9148
453.1305 814.5084
453.6126 728.3696
454.0948 609.3849
454.5769 490.6165
455.0590 390.0470
455.5411 305.7776
456.0232 237.9603
456.5053 190.0027
456.9875 154.3898
457.4696 126.7990
457.9517 106.6802
458.4338 91.50439
458.9159 81.34851
459.3980 74.02893
459.8802 66.13806
460.3623 57.32043
460.8444 50.76208
461.3265 48.39331
461.8086 47.60706
462.2907 46.42493
462.7729 44.60913
463.2550 42.14722
463.7371 38.79700
464.2192 35.01147
464.7013 32.81104
465.1834 34.27148
465.6656 34.47229
466.1477 30.91248
466.6298 26.32410
467.1119 24.20972
467.5940 25.23328
468.0761 27.03845
468.5583 26.61511
469.0404 23.35571
469.5225 21.98975
470.0046 24.12952
470.4867 26.49646
470.9688 28.80432
471.4510 30.48083
471.9331 30.41028
472.4152 27.89490
472.8973 24.55676
473.3794 23.52722
473.8615 25.50696
474.3437 27.60681
474.8258 30.54834
475.3079 32.10071
475.7900 29.88684
476.2721 24.54150
476.7542 19.68689
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