#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-05-24 15:22:07 +0300 (Thu, 24 May 2018) $
#$Revision: 681 $
#$URL: svn://172.16.1.111/rod/cif/2/10/00/2100021.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_2100021
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 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            R050651.rod
_rod_data_source.block           3500000
_rod_database.code               2100021
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
149.5641 0.0000000E+00
150.0462 8.926758
150.5283 38.53027
151.0105 72.15479
151.4926 80.01758
151.9747 82.71875
152.4568 84.92700
152.9389 84.83740
153.4210 84.22876
153.9032 85.80981
154.3853 93.58228
154.8674 100.1069
155.3495 102.3787
155.8316 97.60156
156.3137 94.46240
156.7959 95.93359
157.2780 99.67358
157.7601 101.3040
158.2422 96.68604
158.7243 92.07666
159.2065 91.02197
159.6886 95.63330
160.1707 99.88696
160.6528 102.5862
161.1349 103.6458
161.6170 102.7397
162.0992 98.81177
162.5813 93.48120
163.0634 87.72754
163.5455 81.28296
164.0276 75.15112
164.5097 69.92773
164.9919 65.35986
165.4740 60.88965
165.9561 56.72266
166.4382 52.36768
166.9203 47.30005
167.4024 40.92676
167.8846 37.22192
168.3667 36.72925
168.8488 36.45288
169.3309 34.53394
169.8130 36.37329
170.2952 38.04053
170.7773 36.43726
171.2594 29.18506
171.7415 21.59546
172.2236 20.25610
172.7057 23.76978
173.1879 27.11890
173.6700 28.12402
174.1521 27.73364
174.6342 27.56543
175.1163 29.41919
175.5984 31.14551
176.0806 29.84912
176.5627 25.49585
177.0448 20.52173
177.5269 16.73218
178.0090 14.50195
178.4911 13.86523
178.9733 15.18457
179.4554 15.05981
179.9375 14.29150
180.4196 13.29688
180.9017 11.81665
181.3838 8.788574
181.8660 4.831543
182.3481 1.936768
182.8302 1.957520
183.3123 3.683838
183.7944 4.556396
184.2766 4.525391
184.7587 3.302002
185.2408 0.3288570
185.7229 4.146729
186.2050 8.576660
186.6871 12.87085
187.1693 16.54736
187.6514 16.93311
188.1335 13.35547
188.6156 8.506348
189.0977 6.586914
189.5798 7.453857
190.0620 8.029541
190.5441 6.090576
191.0262 2.223389
191.5083 0.4599610
191.9904 1.397705
192.4725 3.463135
192.9547 4.207764
193.4368 3.530029
193.9189 2.755615
194.4010 3.219238
194.8831 4.701660
195.3652 3.681885
195.8474 0.8142090
196.3295 6.787842
196.8116 10.30786
197.2937 11.00732
197.7758 10.61133
198.2579 10.28076
198.7401 9.885254
199.2222 9.103027
199.7043 7.968750
200.1864 7.001709
200.6685 6.945801
201.1507 8.170898
201.6328 9.154541
202.1149 8.451904
202.5970 5.722656
203.0791 5.034668
203.5612 7.820313
204.0434 13.08862
204.5255 13.73291
205.0076 9.625244
205.4897 4.758789
205.9718 1.473145
206.4539 0.1328130
206.9361 1.539307
207.4182 4.252686
207.9003 6.934814
208.3824 5.831543
208.8645 0.3776860
209.3466 6.894043
209.8288 10.80981
210.3109 11.66284
210.7930 11.83813
211.2751 11.19971
211.7572 10.10986
212.2393 10.01636
212.7215 11.26489
213.2036 12.72388
213.6857 13.57373
214.1678 13.36304
214.6499 14.29541
215.1320 17.14331
215.6142 20.92114
216.0963 21.82056
216.5784 18.92456
217.0605 15.27588
217.5426 12.56274
218.0247 10.62500
218.5069 10.33911
218.9890 12.73267
219.4711 16.89258
219.9532 18.15674
220.4353 14.90869
220.9175 11.49048
221.3996 10.88818
221.8817 14.57764
222.3638 17.23047
222.8459 17.97266
223.3280 17.28931
223.8102 17.74536
224.2923 19.74048
224.7744 21.59399
225.2565 22.32715
225.7386 21.59448
226.2207 20.84985
226.7029 20.05884
227.1850 19.31152
227.6671 19.18750
228.1492 20.21631
228.6313 21.12256
229.1134 20.99048
229.5956 19.02271
230.0777 17.85376
230.5598 17.94751
231.0419 19.06812
231.5240 19.91357
232.0062 20.17432
232.4883 20.65283
232.9704 22.16943
233.4525 26.34961
233.9346 27.83838
234.4167 24.56909
234.8989 18.09082
235.3810 15.99463
235.8631 21.01904
236.3452 26.74390
236.8273 29.39795
237.3094 27.28125
237.7916 25.69385
238.2737 25.10645
238.7558 25.22803
239.2379 24.81421
239.7200 23.13794
240.2021 21.84961
240.6843 22.10327
241.1664 25.45386
241.6485 26.88135
242.1306 25.57275
242.6127 22.22607
243.0948 19.18115
243.5770 15.27954
244.0591 12.82593
244.5412 13.82471
245.0233 22.49658
245.5054 25.42529
245.9876 19.87451
246.4697 9.026367
246.9518 2.354980
247.4339 1.027588
247.9160 1.711914
248.3981 3.253906
248.8803 6.625977
249.3624 8.632080
249.8445 8.025146
250.3266 5.983643
250.8087 6.221680
251.2908 9.946533
251.7730 14.10864
252.2551 17.36646
252.7372 19.89917
253.2193 20.88672
253.7014 19.99487
254.1835 17.79907
254.6657 15.93848
255.1478 14.66016
255.6299 13.30615
256.1120 11.72681
256.5941 10.19897
257.0763 7.338135
257.5584 1.703857
258.0405 4.336670
258.5226 5.493652
259.0047 0.6516110
259.4868 6.729736
259.9690 9.769287
260.4511 9.013184
260.9332 8.723389
261.4153 9.244385
261.8974 9.947754
262.3795 9.470703
262.8617 6.824219
263.3438 5.374268
263.8259 6.777588
264.3080 11.70630
264.7901 14.25610
265.2722 13.32178
265.7544 11.13916
266.2365 11.40015
266.7186 15.28931
267.2007 19.07861
267.6828 21.85425
268.1649 23.71167
268.6471 23.04810
269.1292 19.23657
269.6113 13.92505
270.0934 8.868164
270.5755 3.817383
271.0576 0.1596680
271.5398 2.923584
272.0219 4.475098
272.5040 3.954590
272.9861 0.9504390
273.4682 3.174805
273.9503 7.619141
274.4325 12.74951
274.9146 15.78662
275.3967 15.48633
275.8788 12.31909
276.3610 10.07324
276.8431 8.888184
277.3252 8.345459
277.8073 8.205078
278.2894 8.504639
278.7715 8.823730
279.2537 9.556885
279.7358 10.26587
280.2179 8.136230
280.7000 2.457275
281.1821 2.823486
281.6642 4.233887
282.1464 1.743408
282.6285 1.107422
283.1106 3.875732
283.5927 6.518066
284.0748 9.359131
284.5569 12.56128
285.0391 14.28076
285.5212 11.80518
286.0033 5.653564
286.4854 2.609375
286.9675 4.139648
287.4496 8.102295
287.9318 10.79541
288.4139 12.22510
288.8960 12.17969
289.3781 9.295898
289.8602 4.442139
290.3423 2.319092
290.8245 3.850098
291.3066 6.990479
291.7887 8.753662
292.2708 9.257324
292.7529 9.252930
293.2350 9.195313
293.7172 9.029541
294.1993 8.012207
294.6814 5.866943
295.1635 4.012207
295.6456 4.637939
296.1277 7.238037
296.6099 9.707764
297.0920 11.56860
297.5741 12.47070
298.0562 10.65283
298.5383 5.823242
299.0204 1.845947
299.5026 4.195068
299.9847 10.70337
300.4668 15.31812
300.9489 14.37183
301.4311 10.96216
301.9132 9.153564
302.3953 8.975830
302.8774 9.687012
303.3595 12.17188
303.8416 14.89697
304.3238 14.87524
304.8059 8.395752
305.2880 1.420654
305.7701 0.4755860
306.2522 4.912354
306.7343 10.65527
307.2165 16.85938
307.6986 22.08472
308.1807 24.29883
308.6628 21.73242
309.1449 18.26733
309.6270 17.00317
310.1092 17.26514
310.5913 17.01294
311.0734 13.09692
311.5555 9.211182
312.0376 9.044922
312.5197 14.45825
313.0019 20.28613
313.4840 24.41626
313.9661 26.91626
314.4482 27.99390
314.9303 25.78149
315.4124 23.49780
315.8946 23.34399
316.3767 26.47974
316.8588 29.65234
317.3409 32.34644
317.8230 33.58130
318.3051 32.21021
318.7873 24.92822
319.2694 17.60547
319.7515 12.42090
320.2336 9.541260
320.7157 8.248779
321.1978 9.398193
321.6800 11.59351
322.1621 13.53174
322.6442 14.53223
323.1263 15.60083
323.6084 17.24023
324.0905 19.36499
324.5727 20.73560
325.0548 20.48633
325.5369 19.87109
326.0190 19.65820
326.5012 21.06689
326.9833 21.58594
327.4654 20.06592
327.9475 17.27734
328.4296 16.21948
328.9117 16.82568
329.3939 19.00781
329.8760 23.38257
330.3581 34.06519
330.8402 39.65527
331.3223 37.31299
331.8044 30.45312
332.2866 26.24097
332.7687 25.80908
333.2508 26.28271
333.7329 26.93994
334.2150 27.92407
334.6971 28.10059
335.1793 26.82544
335.6614 25.38208
336.1435 25.93921
336.6256 30.11597
337.1077 32.05737
337.5898 29.22168
338.0720 22.05640
338.5541 19.80737
339.0362 24.31250
339.5183 29.27295
340.0004 28.45044
340.4825 20.96777
340.9647 13.79028
341.4468 7.331055
341.9289 2.362305
342.4110 2.051270
342.8931 6.858154
343.3752 13.04004
343.8574 18.59546
344.3395 23.46313
344.8216 26.56934
345.3037 27.18188
345.7858 26.22510
346.2679 26.42798
346.7501 27.74072
347.2322 28.64038
347.7143 27.78906
348.1964 25.83447
348.6785 25.00122
349.1607 25.48071
349.6428 26.44873
350.1249 27.60742
350.6070 28.63818
351.0891 28.51416
351.5713 26.35205
352.0534 23.05493
352.5355 19.41089
353.0176 15.52588
353.4997 12.58032
353.9818 12.20264
354.4640 13.24316
354.9461 14.09277
355.4282 15.06470
355.9103 14.69043
356.3924 9.675537
356.8745 1.618652
357.3567 3.474609
357.8388 1.066895
358.3209 7.875977
358.8030 10.36255
359.2851 5.701172
359.7672 1.046387
360.2494 0.1694340
360.7315 1.976807
361.2136 4.428223
361.6957 8.189453
362.1778 11.24414
362.6599 12.00220
363.1421 9.918945
363.6242 8.832031
364.1063 12.04663
364.5884 15.91260
365.0705 16.66699
365.5526 8.164307
366.0348 2.059082
366.5169 2.576172
366.9990 9.234375
367.4811 13.39648
367.9632 12.11230
368.4453 9.564453
368.9275 8.340088
369.4096 7.496826
369.8917 8.554443
370.3738 13.87793
370.8559 21.24878
371.3380 24.12451
371.8202 19.76514
372.3023 14.68164
372.7844 11.38647
373.2665 10.41406
373.7487 9.053711
374.2308 6.994873
374.7129 4.882813
375.1950 3.464355
375.6771 2.651611
376.1592 2.979004
376.6414 5.196777
377.1235 8.961182
377.6056 10.43970
378.0877 9.054688
378.5698 7.418701
379.0519 8.444824
379.5341 12.15723
380.0162 14.03198
380.4983 12.80054
380.9804 9.902344
381.4625 8.883057
381.9446 9.685791
382.4268 10.03662
382.9089 7.085205
383.3910 2.432373
383.8731 2.328369
384.3552 8.138672
384.8373 14.12500
385.3195 11.76709
385.8016 3.763428
386.2837 1.922119
386.7658 0.7692870
387.2479 6.515625
387.7300 8.145020
388.2122 5.802246
388.6943 3.608398
389.1764 4.418701
389.6585 7.226074
390.1406 11.05591
390.6227 17.41455
391.1049 22.14062
391.5870 21.58643
392.0691 16.96167
392.5512 11.91479
393.0333 5.968262
393.5154 1.632568
393.9976 0.8227540
394.4797 4.525635
394.9618 9.208740
395.4439 16.37036
395.9260 23.14282
396.4081 25.69751
396.8903 19.34888
397.3724 12.61548
397.8545 7.251465
398.3366 3.313477
398.8188 1.506592
399.3009 3.967041
399.7830 7.194580
400.2651 9.061523
400.7472 10.12500
401.2293 8.736328
401.7115 2.424316
402.1936 6.207520
402.6757 8.792480
403.1578 2.266113
403.6399 5.050537
404.1220 9.900146
404.6042 12.18628
405.0863 12.37549
405.5684 9.650635
406.0505 6.111328
406.5326 4.615723
407.0147 5.414551
407.4969 6.423340
407.9790 7.091553
408.4611 7.576660
408.9432 8.826660
409.4253 10.98486
409.9074 12.47314
410.3896 11.58496
410.8717 8.855469
411.3538 6.710449
411.8359 5.938721
412.3180 5.642334
412.8001 4.112305
413.2823 1.944580
413.7644 0.1369630
414.2465 2.762939
414.7286 4.663086
415.2107 3.855957
415.6928 6.3477002E-02
416.1750 4.510742
416.6571 9.896484
417.1392 14.55859
417.6213 16.52637
418.1034 12.53979
418.5855 8.411621
419.0677 8.176514
419.5498 10.82422
420.0319 12.55029
420.5140 10.49219
420.9961 8.005371
421.4782 7.238770
421.9604 9.116699
422.4425 11.02319
422.9246 12.39844
423.4067 13.46118
423.8889 14.53638
424.3710 18.64697
424.8531 19.57202
425.3352 13.86719
425.8173 1.482422
426.2994 5.464600
426.7816 4.739746
427.2637 0.6618650
427.7458 4.152344
428.2279 11.26123
428.7100 15.67383
429.1921 16.31665
429.6743 14.55786
430.1564 13.70581
430.6385 14.24487
431.1206 13.75586
431.6027 9.869873
432.0848 2.912109
432.5670 1.875977
433.0491 7.564941
433.5312 15.95996
434.0133 23.58081
434.4954 30.43286
434.9775 36.36499
435.4597 40.98682
435.9418 45.15845
436.4239 49.98438
436.9060 55.47437
437.3881 61.96191
437.8702 71.56689
438.3524 81.58081
438.8345 87.45044
439.3166 88.15723
439.7987 88.24780
440.2808 91.60742
440.7629 96.65015
441.2451 100.8755
441.7272 101.1101
442.2093 102.1797
442.6914 107.8721
443.1735 117.3662
443.6556 125.1016
444.1378 126.5000
444.6199 127.3059
445.1020 130.8281
445.5841 137.3044
446.0662 147.0303
446.5483 162.0383
447.0305 179.9851
447.5126 197.0598
447.9947 212.1885
448.4768 227.3801
448.9590 242.7642
449.4411 258.2346
449.9232 275.7419
450.4053 297.3801
450.8874 318.2053
451.3695 336.2603
451.8517 353.9912
452.3338 358.0420
452.8159 346.2327
453.2980 321.2378
453.7801 284.2273
454.2622 234.5146
454.7444 187.1951
455.2265 148.6501
455.7086 118.1372
456.1907 94.73340
456.6728 78.36792
457.1549 67.04956
457.6371 60.17188
458.1192 56.60498
458.6013 53.73120
459.0834 51.73926
459.5655 48.76587
460.0476 40.90918
460.5298 29.95020
461.0119 21.61157
461.4940 20.41846
461.9761 21.06250
462.4582 18.93237
462.9403 13.37476
463.4225 9.065918
463.9046 8.976074
464.3867 10.78784
464.8688 12.71631
465.3509 15.23340
465.8330 15.76636
466.3152 12.29102
466.7973 6.414063
467.2794 2.931152
467.7615 5.453857
468.2436 7.079102
468.7257 4.405029
469.2079 4.799072
469.6900 7.381836
470.1721 0.6782230
470.6542 10.95117
471.1363 13.89087
471.6184 7.353027
472.1006 2.271240
472.5827 0.8256840
473.0648 2.156494
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1301.342 1.716309
1301.824 0.0000000E+00
