#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 14:07:11 +0300 (Thu, 26 Apr 2018) $
#$Revision: 646 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000180.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_1000180
loop_
_publ_author_name
'Bindi, L.'
'Menchetti, S.'
_publ_section_title
;
 Fast ion conduction character and ionic phase-transition in silver
 sulfosalts: The case of fettelite [Ag6As2S7][Ag10HgAs2S8] Note: T = 400 K
;
_journal_name_full               'American Mineralogist'
_journal_page_first              792
_journal_page_last               796
_journal_paper_doi               10.2138/am.2011.3736
_journal_volume                  96
_journal_year                    2011
_chemical_compound_source        R110042
_chemical_formula_sum            'Ag17.742 As3.552 S15 Sb0.448'
_chemical_name_mineral           Fettelite
_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                   7.5984
_cell_length_b                   7.5984
_cell_length_c                   15.557
_cell_volume                     777.859
_exptl_crystal_density_diffrn    5.797
_cod_original_formula_sum        'Ag17.742 As3.552 Sb.448 S15'
_cod_database_code               9016074
_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            R110042.rod
_rod_data_source.block           3500000
_rod_database.code               1000180
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 9016074 COD http://www.crystallography.net/cod/9016074.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
169.2243 0.0000000E+00
169.7064 9.6439999E-03
170.1885 1.055878
170.6707 2.512787
171.1528 2.944763
171.6349 2.467590
172.1170 2.154633
172.5991 2.251038
173.0812 3.125793
173.5634 3.275330
174.0455 1.317261
174.5276 0.3835140
175.0097 0.5773620
175.4918 0.5841980
175.9739 2.001007
176.4561 2.420715
176.9382 1.464691
177.4203 0.7664180
177.9024 0.2897950
178.3845 5.6334998E-02
178.8666 0.1167600
179.3488 0.4584350
179.8309 1.014954
180.3130 1.720825
180.7951 2.715942
181.2772 3.524139
181.7593 4.293671
182.2415 4.817657
182.7236 4.898987
183.2057 4.506500
183.6878 3.789581
184.1699 2.914612
184.6520 1.448151
185.1342 0.8067320
185.6163 1.550659
186.0984 2.911163
186.5805 4.189880
187.0626 5.199890
187.5447 5.894806
188.0269 6.099121
188.5090 5.741272
188.9911 5.323822
189.4732 4.465179
189.9553 3.688965
190.4374 4.181641
190.9196 6.685760
191.4017 9.668182
191.8838 10.88089
192.3659 10.32266
192.8480 9.339630
193.3301 8.095642
193.8123 6.810852
194.2944 6.434082
194.7765 7.825226
195.2586 9.443451
195.7407 9.581970
196.2228 8.218506
196.7050 6.692444
197.1871 5.820404
197.6692 5.595856
198.1513 5.910675
198.6334 7.445496
199.1155 8.921997
199.5977 9.314697
200.0798 8.616150
200.5619 7.792542
201.0440 7.899719
201.5261 9.128632
202.0082 10.01291
202.4904 10.31470
202.9725 10.25220
203.4546 9.600830
203.9367 8.471191
204.4188 7.526428
204.9009 7.779327
205.3831 9.848206
205.8652 11.20352
206.3473 11.20685
206.8294 10.95346
207.3115 11.03470
207.7936 11.55695
208.2758 12.27664
208.7579 12.90628
209.2400 13.61728
209.7221 13.79440
210.2042 12.42819
210.6863 11.30957
211.1685 11.83383
211.6506 14.18811
212.1327 17.41287
212.6148 20.26935
213.0969 23.34589
213.5790 24.40686
214.0612 21.89502
214.5433 18.49588
215.0254 16.29218
215.5075 15.78897
215.9896 16.06256
216.4717 15.75330
216.9539 14.12064
217.4360 13.85205
217.9181 16.47281
218.4002 19.73596
218.8823 21.23074
219.3644 20.36441
219.8466 18.68964
220.3287 18.32840
220.8108 19.53210
221.2929 20.53809
221.7750 21.01669
222.2571 21.21356
222.7393 21.39725
223.2214 21.61368
223.7035 21.88098
224.1856 22.16058
224.6677 22.44559
225.1498 23.04126
225.6320 24.29507
226.1141 25.84348
226.5962 27.10654
227.0783 27.87631
227.5604 28.37790
228.0425 28.87024
228.5247 29.29141
229.0068 29.17566
229.4889 27.68362
229.9710 25.58646
230.4531 24.77289
230.9352 25.92511
231.4174 27.33670
231.8995 27.58484
232.3816 27.01816
232.8637 26.57886
233.3458 26.90948
233.8279 27.73740
234.3101 28.15021
234.7922 27.86655
235.2743 27.60562
235.7564 27.46255
236.2385 27.62134
236.7206 28.56284
237.2028 31.31677
237.6849 35.12079
238.1670 36.48322
238.6491 33.52206
239.1312 30.84894
239.6133 30.57162
240.0955 31.79721
240.5776 33.02698
241.0597 33.45007
241.5418 33.16135
242.0239 32.51044
242.5060 30.61389
242.9882 29.64005
243.4703 30.93445
243.9524 33.30685
244.4345 34.99396
244.9166 34.89709
245.3987 33.43842
245.8809 32.69299
246.3630 34.02100
246.8451 34.24512
247.3272 31.64456
247.8093 27.92307
248.2914 25.30743
248.7736 25.03357
249.2557 26.59857
249.7378 27.99493
250.2199 29.55688
250.7020 30.46091
251.1841 29.94473
251.6663 28.94739
252.1484 28.65720
252.6305 29.65576
253.1126 31.48907
253.5947 32.73877
254.0768 33.08945
254.5590 33.16394
255.0411 32.79312
255.5232 32.23572
256.0053 31.74942
256.4874 31.44986
256.9695 31.30457
257.4517 31.27588
257.9338 31.91080
258.4159 31.91016
258.8980 30.63736
259.3801 28.94547
259.8622 27.46027
260.3444 26.41849
260.8265 25.97635
261.3086 26.51001
261.7907 29.24072
262.2728 31.01605
262.7549 30.87265
263.2371 30.20071
263.7192 30.28421
264.2013 31.45377
264.6834 33.34973
265.1655 35.59131
265.6476 38.81754
266.1298 40.68878
266.6119 40.48248
267.0940 39.32816
267.5761 38.00262
268.0582 36.73813
268.5403 35.74167
269.0225 35.44324
269.5046 36.15204
269.9867 35.91870
270.4688 32.96466
270.9509 29.96255
271.4330 29.89709
271.9152 32.97897
272.3973 36.20670
272.8794 36.56860
273.3615 33.79077
273.8436 31.90643
274.3257 32.05328
274.8079 32.35480
275.2900 30.60461
275.7721 26.91748
276.2542 24.52078
276.7363 26.66086
277.2184 32.59998
277.7006 35.35626
278.1827 32.31732
278.6648 28.13138
279.1469 25.86981
279.6290 25.42661
280.1111 25.48059
280.5933 25.39954
281.0754 25.18741
281.5575 24.88995
282.0396 24.19467
282.5217 23.80676
283.0038 24.55737
283.4860 26.17303
283.9681 27.19327
284.4502 26.84747
284.9323 25.55838
285.4144 24.20984
285.8965 22.51068
286.3787 21.42139
286.8608 21.86981
287.3429 23.45496
287.8250 24.72150
288.3071 25.16177
288.7892 25.14453
289.2714 25.24002
289.7535 25.48401
290.2356 25.60629
290.7177 25.39615
291.1998 24.97147
291.6819 24.61252
292.1641 24.36612
292.6462 24.22888
293.1283 24.16980
293.6104 24.18597
294.0925 24.35968
294.5746 24.80475
295.0568 25.41769
295.5389 25.99622
296.0210 26.51160
296.5031 27.00928
296.9852 27.68848
297.4673 28.41898
297.9495 28.75418
298.4316 28.11209
298.9137 27.16147
299.3958 27.12265
299.8779 28.26654
300.3600 29.11227
300.8422 28.07452
301.3243 26.14713
301.8064 25.14105
302.2885 26.27751
302.7706 27.67369
303.2527 26.74916
303.7349 23.30045
304.2170 20.41882
304.6991 20.40392
305.1812 21.39029
305.6633 20.69916
306.1454 17.47719
306.6276 13.88586
307.1097 11.78859
307.5918 11.12303
308.0739 10.75031
308.5560 10.41243
309.0381 10.15790
309.5203 10.27887
310.0024 10.87758
310.4845 10.80484
310.9666 8.566086
311.4487 4.735764
311.9308 2.314758
312.4130 2.507278
312.8951 3.397675
313.3772 3.220917
313.8593 2.111282
314.3414 0.9037480
314.8235 0.3856660
315.3057 1.457108
315.7878 1.289337
316.2699 0.7650910
316.7520 2.704712
317.2341 2.896637
317.7162 1.880890
318.1984 0.7006840
318.6805 0.3450470
319.1626 1.304199
319.6447 2.341904
320.1268 3.540817
320.6089 4.403625
321.0911 4.537521
321.5732 4.175110
322.0553 3.528549
322.5374 2.447250
323.0195 1.407364
323.5016 1.087463
323.9838 1.496902
324.4659 1.496338
324.9480 3.8449999E-03
325.4301 1.628128
325.9122 1.490128
326.3943 0.8967900
326.8765 3.066589
327.3586 3.008423
327.8407 1.086609
328.3228 0.7843170
328.8049 2.442764
329.2870 3.502869
329.7692 3.261749
330.2513 1.859741
330.7334 0.9398650
331.2155 1.643555
331.6976 3.367966
332.1797 4.840866
332.6619 6.058304
333.1440 6.658813
333.6261 5.868851
334.1082 4.199356
334.5903 2.810928
335.0724 2.149002
335.5546 1.914795
336.0367 1.739578
336.5188 1.607193
337.0009 1.630844
337.4830 1.726303
337.9651 2.107468
338.4473 3.256683
338.9294 5.834793
339.4115 8.250961
339.8936 8.938354
340.3757 8.100555
340.8578 7.482849
341.3400 7.864822
341.8221 8.659225
342.3042 8.918549
342.7863 8.558563
343.2684 8.178879
343.7505 7.767532
344.2327 7.563049
344.7148 8.444672
345.1969 11.01981
345.6790 13.55602
346.1611 13.41531
346.6432 11.06711
347.1254 9.576477
347.6075 10.34450
348.0896 12.10333
348.5717 13.34367
349.0538 13.93370
349.5359 14.37282
350.0181 15.11137
350.5002 15.99573
350.9823 16.39983
351.4644 15.78200
351.9465 15.11205
352.4286 15.00111
352.9108 15.39838
353.3929 16.01813
353.8750 16.66705
354.3571 17.51221
354.8392 19.07988
355.3214 21.90111
355.8035 24.20003
356.2856 24.63875
356.7677 24.25046
357.2498 25.05742
357.7319 27.75629
358.2141 31.04308
358.6962 33.05528
359.1783 33.52797
359.6604 34.44887
360.1425 36.62210
360.6246 38.99242
361.1068 40.25800
361.5889 40.41371
362.0710 40.87914
362.5531 42.87230
363.0352 46.42836
363.5173 50.03392
363.9995 54.24680
364.4816 57.97458
364.9637 60.06517
365.4458 61.35757
365.9279 63.75584
366.4100 68.34254
366.8922 74.20598
367.3743 78.44051
367.8564 79.94733
368.3385 81.51695
368.8206 83.10817
369.3027 85.09482
369.7849 88.26901
370.2670 92.77284
370.7491 97.39465
371.2312 100.2634
371.7133 100.1348
372.1954 102.1191
372.6776 107.9496
373.1597 114.1534
373.6418 119.1892
374.1239 122.8727
374.6060 125.0870
375.0881 125.6180
375.5703 124.5376
376.0524 124.5807
376.5345 127.8972
377.0166 129.9120
377.4987 129.1043
377.9808 126.2760
378.4630 122.4096
378.9451 117.9901
379.4272 113.1037
379.9093 107.9817
380.3914 103.3766
380.8735 97.14178
381.3557 87.22939
381.8378 77.13049
382.3199 69.50259
382.8020 64.71892
383.2841 61.30475
383.7662 57.74803
384.2484 53.93323
384.7305 49.73267
385.2126 44.79019
385.6947 40.18016
386.1768 36.01985
386.6589 32.35651
387.1411 29.36449
387.6232 27.21155
388.1053 25.66649
388.5874 23.91571
389.0695 21.67238
389.5516 19.89995
390.0338 19.04465
390.5159 18.53835
390.9980 18.03069
391.4801 17.40393
391.9622 16.36038
392.4443 14.13016
392.9265 10.48146
393.4086 8.036636
393.8907 8.071167
394.3728 8.554581
394.8549 8.603485
395.3370 8.138596
395.8192 7.102051
396.3013 4.611252
396.7834 1.541794
397.2655 1.213196
397.7476 4.754532
398.2297 8.070679
398.7119 8.822540
399.1940 8.132462
399.6761 7.258881
400.1582 6.467087
400.6403 5.671738
401.1224 4.635849
401.6046 3.386887
402.0867 2.623306
402.5688 2.667465
403.0509 3.204056
403.5330 3.900696
404.0151 4.764664
404.4973 5.459442
404.9794 5.861282
405.4615 5.995865
405.9436 5.799423
406.4257 5.219940
406.9078 4.654282
407.3900 4.485748
407.8721 4.630524
408.3542 4.616150
408.8363 4.389694
409.3184 4.002396
409.8005 3.116043
410.2827 2.024933
410.7648 1.956131
411.2469 3.736481
411.7290 6.271683
412.2111 6.926605
412.6932 5.035400
413.1754 3.278870
413.6575 1.835526
414.1396 0.8922730
414.6217 0.7833560
415.1038 1.517014
415.5859 2.615280
416.0681 3.666214
416.5502 4.689392
417.0323 5.330338
417.5144 5.256454
417.9965 5.212036
418.4786 5.738220
418.9608 6.489288
419.4429 6.734116
419.9250 6.078690
420.4071 4.838394
420.8892 3.918320
421.3713 4.124313
421.8535 3.383514
422.3356 0.6763760
422.8177 2.266190
423.2998 4.445801
423.7819 5.556091
424.2640 5.341034
424.7462 3.143997
425.2283 1.287308
425.7104 4.060654
426.1925 3.559341
426.6746 3.052902
427.1567 3.694946
427.6389 4.893539
428.1210 5.641479
428.6031 5.429810
429.0852 4.656052
429.5673 4.050339
430.0494 3.546783
430.5316 3.440369
431.0137 4.202240
431.4958 5.128326
431.9779 6.165558
432.4600 7.163422
432.9421 7.164230
433.4243 4.238464
433.9064 0.5465390
434.3885 2.154648
434.8706 0.8739470
435.3527 4.206085
435.8348 4.701706
436.3170 3.677124
436.7991 3.348984
437.2812 4.803177
437.7633 6.336761
438.2454 5.950439
438.7275 3.978363
439.2097 2.866760
439.6918 3.755539
440.1739 5.424591
440.6560 5.918472
441.1381 5.135040
441.6202 4.735077
442.1024 5.826431
442.5845 7.190582
443.0666 7.307251
443.5487 6.090652
444.0308 4.577972
444.5129 3.476303
444.9951 2.769562
445.4772 2.191147
445.9593 1.286240
446.4414 1.008881
446.9235 2.427078
447.4056 4.431641
447.8878 5.104507
448.3699 3.824142
448.8520 1.972321
449.3341 1.724640
449.8162 3.892181
450.2983 5.408966
450.7805 6.065002
451.2626 6.366425
451.7447 6.498489
452.2268 6.508987
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453.1910 6.136292
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454.1553 5.571091
454.6374 5.533783
455.1195 5.572189
455.6016 5.734238
456.0837 5.945038
456.5659 6.220261
457.0480 6.519806
457.5301 6.619598
458.0122 5.854858
458.4943 4.266876
458.9764 4.447327
459.4586 8.037918
459.9407 11.03871
460.4228 10.98500
460.9049 9.060638
461.3870 7.308868
461.8691 6.399994
462.3513 6.019821
462.8334 5.970200
463.3155 6.230820
463.7976 6.291153
464.2797 6.007660
464.7618 5.469528
465.2440 4.415131
465.7261 2.758698
466.2082 2.000320
466.6903 3.275146
467.1724 5.368698
467.6545 7.012299
468.1367 8.070709
468.6188 8.431717
469.1009 7.815125
469.5830 6.495514
470.0651 5.831818
470.5472 6.571823
471.0294 6.912476
471.5115 6.019211
471.9936 4.633331
472.4757 3.546402
472.9578 3.011993
473.4399 3.153198
473.9221 4.293015
474.4042 6.826355
474.8863 8.014542
475.3684 6.958221
475.8505 5.685455
476.3326 4.599503
476.8148 3.882919
477.2969 3.792236
477.7790 4.463486
478.2611 5.577606
478.7432 6.647781
479.2253 8.106979
479.7075 8.273315
480.1896 4.768936
480.6717 1.569550
481.1538 1.682175
481.6359 4.551895
482.1180 7.001617
482.6002 6.583969
483.0823 4.474792
483.5644 3.756393
484.0465 4.911972
484.5286 5.610382
485.0107 4.074158
485.4929 1.928513
485.9750 1.114883
486.4571 1.972443
486.9392 3.408051
487.4213 5.445343
487.9034 7.492905
488.3856 8.012817
488.8677 6.637619
489.3498 4.773499
489.8319 3.502197
490.3140 2.826553
490.7961 2.330200
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