#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 13:45:33 +0300 (Thu, 26 Apr 2018) $
#$Revision: 565 $
#$URL: svn://172.16.1.111/rod/cif/1/00/01/1000110.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_1000110
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        Synthetic
_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            R100124.rod
_rod_data_source.block           3500000
_rod_database.code               1000110
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
163.4050 6.643799
163.8871 17.46655
164.3693 26.23218
164.8514 33.30835
165.3335 39.53809
165.8156 44.79688
166.2977 48.95337
166.7798 51.72314
167.2620 53.44434
167.7441 54.45093
168.2262 54.76147
168.7083 54.72900
169.1904 55.58276
169.6725 58.70605
170.1547 60.24365
170.6368 57.41357
171.1189 51.42773
171.6010 46.45117
172.0831 44.44165
172.5652 44.63501
173.0474 45.03198
173.5295 45.95996
174.0116 46.49097
174.4937 45.64917
174.9758 43.42969
175.4579 41.36670
175.9401 40.49731
176.4222 39.90454
176.9043 38.53223
177.3864 35.95801
177.8685 33.06714
178.3506 30.99487
178.8328 29.94312
179.3149 28.98218
179.7970 28.28394
180.2791 27.30859
180.7612 25.64014
181.2433 23.13550
181.7255 19.74170
182.2076 15.33569
182.6897 9.944580
183.1718 3.297607
183.6539 4.573975
184.1360 13.46558
184.6181 23.12817
185.1003 33.45190
185.5824 44.57227
186.0645 56.22852
186.5466 69.02661
187.0287 82.35400
187.5108 96.48779
187.9930 110.9077
188.4751 125.0396
188.9572 138.4927
189.4393 151.3198
189.9214 163.5708
190.4035 172.8306
190.8857 184.1604
191.3678 199.4827
191.8499 217.3716
192.3320 235.7793
192.8141 253.7246
193.2962 270.9426
193.7784 285.4697
194.2605 296.3091
194.7426 306.2432
195.2247 315.9302
195.7068 325.4431
196.1889 334.7915
196.6711 343.6799
197.1532 352.5767
197.6353 363.4214
198.1174 377.3501
198.5995 392.0022
199.0816 404.8274
199.5638 416.5564
200.0459 431.8010
200.5280 453.9934
201.0101 482.1350
201.4922 510.9199
201.9743 540.7437
202.4565 570.8406
202.9386 599.7910
203.4207 627.5759
203.9028 657.5337
204.3849 691.7615
204.8670 729.3499
205.3492 768.8982
205.8313 810.7773
206.3134 853.7737
206.7955 895.6489
207.2776 935.8130
207.7597 977.6270
208.2419 1022.984
208.7240 1070.749
209.2061 1119.958
209.6882 1170.427
210.1703 1222.002
210.6524 1274.775
211.1346 1328.948
211.6167 1382.874
212.0988 1436.145
212.5809 1488.630
213.0630 1540.636
213.5451 1591.994
214.0273 1642.716
214.5094 1692.652
214.9915 1742.184
215.4736 1790.081
215.9557 1837.765
216.4378 1883.478
216.9200 1925.381
217.4021 1962.324
217.8842 1995.956
218.3663 2030.784
218.8484 2071.372
219.3305 2105.865
219.8127 2131.065
220.2948 2150.807
220.7769 2169.115
221.2590 2187.800
221.7411 2206.086
222.2232 2221.570
222.7054 2234.195
223.1875 2243.869
223.6696 2249.342
224.1517 2252.506
224.6338 2255.288
225.1159 2258.620
225.5980 2262.321
226.0802 2265.805
226.5623 2268.675
227.0444 2271.750
227.5265 2276.853
228.0086 2281.620
228.4907 2282.678
228.9729 2278.615
229.4550 2271.092
229.9371 2264.246
230.4192 2259.897
230.9013 2253.114
231.3834 2244.231
231.8656 2232.196
232.3477 2215.248
232.8298 2192.603
233.3119 2165.495
233.7940 2135.397
234.2761 2101.184
234.7583 2067.630
235.2404 2038.114
235.7225 2009.813
236.2046 1976.963
236.6867 1936.657
237.1688 1892.922
237.6510 1852.081
238.1331 1814.447
238.6152 1777.486
239.0973 1740.182
239.5794 1702.998
240.0615 1666.320
240.5437 1628.857
241.0258 1594.761
241.5079 1570.327
241.9900 1554.826
242.4721 1541.141
242.9542 1527.900
243.4364 1514.373
243.9185 1497.868
244.4006 1476.008
244.8827 1454.672
245.3648 1439.591
245.8469 1430.153
246.3290 1423.651
246.8112 1419.142
247.2933 1416.605
247.7754 1415.929
248.2575 1417.185
248.7396 1420.386
249.2217 1424.962
249.7039 1431.039
250.1860 1439.473
250.6681 1450.771
251.1502 1464.739
251.6323 1480.701
252.1144 1497.704
252.5966 1518.484
253.0787 1543.920
253.5608 1573.602
254.0429 1607.141
254.5250 1644.284
255.0071 1684.951
255.4893 1729.284
255.9714 1777.200
256.4535 1829.309
256.9356 1886.395
257.4177 1946.885
257.8998 2008.903
258.3820 2071.886
258.8641 2135.149
259.3462 2196.070
259.8283 2253.316
260.3104 2310.205
260.7925 2370.931
261.2747 2431.688
261.7568 2487.364
262.2389 2535.695
262.7210 2577.545
263.2031 2615.984
263.6852 2651.077
264.1674 2682.028
264.6495 2706.763
265.1316 2728.787
265.6137 2751.749
266.0958 2777.260
266.5779 2804.026
267.0601 2829.072
267.5422 2852.496
268.0243 2873.573
268.5064 2891.473
268.9885 2907.875
269.4706 2923.996
269.9528 2940.302
270.4349 2956.727
270.9170 2973.002
271.3991 2988.158
271.8812 3005.059
272.3633 3024.549
272.8455 3045.099
273.3276 3065.436
273.8097 3085.308
274.2918 3105.322
274.7739 3126.772
275.2560 3151.890
275.7382 3173.443
276.2202 3190.960
276.7024 3206.137
277.1845 3220.856
277.6666 3234.941
278.1487 3246.098
278.6308 3251.498
279.1129 3250.347
279.5951 3245.632
280.0772 3234.501
280.5593 3222.897
281.0414 3213.336
281.5235 3206.185
282.0056 3200.848
282.4878 3196.740
282.9699 3193.703
283.4520 3192.985
283.9341 3192.634
284.4162 3196.040
284.8983 3207.273
285.3805 3223.878
285.8626 3240.425
286.3447 3253.458
286.8268 3262.892
287.3089 3261.801
287.7910 3251.273
288.2732 3230.373
288.7553 3199.206
289.2374 3157.306
289.7195 3104.744
290.2016 3041.793
290.6837 2967.976
291.1659 2876.956
291.6480 2761.108
292.1301 2637.768
292.6122 2507.681
293.0943 2372.127
293.5764 2232.342
294.0586 2088.098
294.5407 1940.618
295.0228 1792.457
295.5049 1639.079
295.9870 1490.555
296.4691 1343.933
296.9513 1203.782
297.4334 1075.126
297.9155 960.1233
298.3976 855.7031
298.8797 757.2603
299.3618 665.1887
299.8440 580.0071
300.3261 502.2063
300.8082 431.4353
301.2903 366.9321
301.7724 308.8350
302.2545 256.4946
302.7367 208.7678
303.2188 165.9927
303.7009 129.2561
304.1830 100.5193
304.6651 75.33447
305.1472 50.08936
305.6294 25.21436
306.1115 4.177490
306.5936 9.996826
307.0757 17.09473
307.5578 19.98535
308.0399 17.94092
308.5221 13.31226
309.0042 6.644287
309.4863 1.822510
309.9684 11.97021
310.4505 23.87256
310.9326 37.31763
311.4148 50.74585
311.8969 64.35620
312.3790 78.19995
312.8611 92.23120
313.3432 106.6458
313.8253 121.7454
314.3075 137.6240
314.7896 153.8196
315.2717 169.2742
315.7538 182.1172
316.2359 196.8618
316.7180 213.7615
317.2001 232.6401
317.6823 252.7598
318.1644 273.9766
318.6465 297.8374
319.1286 326.8274
319.6107 362.6123
320.0928 400.3782
320.5750 440.4470
321.0571 482.1097
321.5392 524.5352
322.0213 567.6296
322.5034 612.7537
322.9855 661.3232
323.4677 714.3218
323.9498 766.7283
324.4319 817.0857
324.9140 868.0460
325.3961 922.8616
325.8782 979.8529
326.3604 1034.821
326.8425 1085.134
327.3246 1130.630
327.8067 1170.001
328.2888 1202.917
328.7709 1231.408
329.2531 1253.209
329.7352 1271.275
330.2173 1289.247
330.6994 1308.624
331.1815 1330.637
331.6636 1358.917
332.1458 1395.181
332.6279 1436.417
333.1100 1481.055
333.5921 1531.183
334.0742 1588.838
334.5563 1654.408
335.0385 1728.189
335.5206 1810.060
336.0027 1901.197
336.4848 1999.610
336.9669 2107.221
337.4490 2220.356
337.9312 2336.340
338.4133 2455.738
338.8954 2580.727
339.3775 2713.819
339.8596 2855.985
340.3417 2996.959
340.8239 3142.517
341.3060 3280.998
341.7881 3415.201
342.2702 3539.056
342.7523 3643.425
343.2344 3723.535
343.7166 3776.777
344.1987 3789.260
344.6808 3753.191
345.1629 3678.894
345.6450 3560.872
346.1271 3407.623
346.6093 3222.971
347.0914 3010.710
347.5735 2778.852
348.0556 2545.286
348.5377 2299.655
349.0198 2070.345
349.5020 1855.542
349.9841 1655.454
350.4662 1472.537
350.9483 1307.145
351.4304 1157.611
351.9125 1023.778
352.3947 906.5953
352.8768 800.5470
353.3589 707.6277
353.8410 623.9224
354.3231 549.6395
354.8052 483.8132
355.2874 424.5459
355.7695 371.0242
356.2516 323.2227
356.7337 279.4783
357.2158 239.7191
357.6979 204.8534
358.1800 174.5801
358.6621 148.9722
359.1443 128.9387
359.6264 114.6293
360.1085 104.3030
360.5906 94.71545
361.0727 85.65430
361.5548 77.95190
362.0370 71.72522
362.5191 66.76593
363.0012 63.55457
363.4833 61.74194
363.9654 60.16016
364.4475 57.72040
364.9297 54.45264
365.4118 50.26935
365.8939 45.15210
366.3760 39.10358
366.8581 31.96802
367.3402 24.02356
367.8224 15.71063
368.3045 7.300354
368.7866 1.184570
369.2687 9.804871
369.7508 18.75299
370.2329 27.32056
370.7151 35.92126
371.1972 43.80634
371.6793 50.36682
372.1614 55.24500
372.6435 59.06024
373.1256 62.46838
373.6078 65.47888
374.0899 67.65936
374.5720 68.75494
375.0541 69.04309
375.5362 68.62115
376.0183 67.58771
376.5005 66.29376
376.9826 65.19550
377.4647 64.08191
377.9468 62.22498
378.4289 59.51697
378.9110 56.18927
379.3932 51.76221
379.8753 46.90302
380.3574 42.98560
380.8395 41.12933
381.3216 39.77298
381.8037 36.87787
382.2859 32.42767
382.7680 27.78857
383.2501 23.49237
383.7322 19.35602
384.2143 15.02518
384.6964 10.29291
385.1786 5.994598
385.6607 2.953369
386.1428 0.6795350
386.6249 2.016174
387.1070 5.387939
387.5891 9.357452
388.0713 14.10223
388.5534 19.53891
389.0355 24.79370
389.5176 29.58197
389.9997 34.18011
390.4818 39.01324
390.9640 44.05179
391.4461 48.61310
391.9282 51.99069
392.4103 54.52838
392.8924 58.05411
393.3745 62.88062
393.8567 68.23734
394.3388 74.50748
394.8209 81.02414
395.3030 86.27716
395.7851 89.58286
396.2672 92.08203
396.7494 95.83591
397.2315 101.7127
397.7136 106.7911
398.1957 110.2465
398.6778 113.3160
399.1599 116.9609
399.6420 121.2880
400.1241 125.9848
400.6063 130.8665
401.0884 135.9568
401.5705 140.3266
402.0526 143.2374
402.5347 146.3477
403.0168 150.1913
403.4990 154.5668
403.9811 159.1962
404.4632 163.9565
404.9453 168.7173
405.4274 173.1601
405.9095 177.2289
406.3917 181.0571
406.8738 184.8004
407.3559 188.2306
407.8380 190.7995
408.3201 192.6861
408.8022 194.9325
409.2844 198.6997
409.7665 204.1118
410.2486 209.1080
410.7307 213.5337
411.2128 217.6661
411.6949 221.5095
412.1771 225.1287
412.6592 228.5878
413.1413 231.8963
413.6234 235.1324
414.1055 238.5038
414.5876 242.1116
415.0698 245.5358
415.5519 248.5458
416.0340 251.4299
416.5161 254.4049
416.9982 257.4854
417.4803 260.5038
417.9625 263.1282
418.4446 265.4798
418.9267 268.5182
419.4088 272.8797
419.8909 276.8909
420.3730 278.7906
420.8552 279.6156
421.3373 281.5937
421.8194 286.2319
422.3015 291.5504
422.7836 295.1788
423.2657 297.1302
423.7479 298.5661
424.2300 299.5687
424.7121 300.6408
425.1942 302.5301
425.6763 305.3427
426.1584 308.3394
426.6406 311.1721
427.1227 313.6053
427.6048 315.3995
428.0869 316.4972
428.5690 316.4599
429.0511 314.7564
429.5333 311.4927
430.0154 308.5618
430.4975 306.7186
430.9796 304.6642
431.4617 301.6865
431.9438 297.9824
432.4260 294.0207
432.9081 290.0262
433.3902 286.0528
433.8723 282.2003
434.3544 279.1478
434.8365 275.0792
435.3187 268.9698
435.8008 262.5155
436.2829 257.1140
436.7650 252.9483
437.2471 249.5095
437.7292 246.3671
438.2114 243.4778
438.6935 240.0677
439.1756 235.5463
439.6577 231.1946
440.1398 227.6187
440.6219 224.4110
441.1040 220.8362
441.5862 216.5910
442.0683 212.3070
442.5504 209.2713
443.0325 207.9613
443.5146 206.2516
443.9967 203.8642
444.4789 201.0632
444.9610 197.6668
445.4431 193.9425
445.9252 190.6141
446.4073 188.2307
446.8894 186.6477
447.3716 185.4522
447.8537 184.8040
448.3358 184.0619
448.8179 182.9372
449.3000 181.5492
449.7821 179.8752
450.2643 177.7905
450.7464 175.8853
451.2285 174.9939
451.7106 174.8631
452.1927 173.9951
452.6748 171.7157
453.1570 169.3715
453.6391 168.6099
454.1212 169.0537
454.6033 169.1521
455.0854 168.6004
455.5675 167.5524
456.0497 165.7731
456.5318 163.4425
457.0139 161.6255
457.4960 161.0007
457.9781 161.1024
458.4602 160.6363
458.9424 159.3772
459.4245 158.1320
459.9066 157.0404
460.3887 156.0108
460.8708 155.0365
461.3529 154.0842
461.8351 152.9607
462.3172 151.4428
462.7993 149.5103
463.2814 147.7372
463.7635 145.7436
464.2456 144.3190
464.7278 144.2033
465.2099 144.5909
465.6920 144.3193
466.1741 142.9490
466.6562 141.0629
467.1383 139.7048
467.6205 139.1849
468.1026 138.2624
468.5847 136.3760
469.0668 134.5314
469.5489 133.3028
470.0310 132.5079
470.5132 131.5555
470.9953 129.9757
471.4774 128.1013
471.9595 126.9861
472.4416 127.0169
472.9237 126.3655
473.4059 123.4175
473.8880 120.0769
474.3701 118.2490
474.8522 118.1951
475.3343 118.2114
475.8164 117.3366
476.2986 115.7015
476.7807 113.5104
477.2628 110.7106
477.7449 107.7967
478.2270 104.9184
478.7091 102.2223
479.1913 100.2466
479.6734 99.59642
480.1555 99.05533
480.6376 98.10757
481.1197 96.78770
481.6018 95.14438
482.0839 93.18259
482.5660 90.99716
483.0482 88.63342
483.5303 85.87892
484.0124 83.87505
484.4945 83.29752
484.9766 82.79495
485.4587 81.70081
485.9409 80.08774
486.4230 78.26357
486.9051 76.38916
487.3872 74.46455
487.8693 72.48407
488.3514 70.25626
488.8336 68.35883
489.3157 66.92358
489.7978 65.70839
490.2799 64.73975
490.7620 63.89456
491.2441 62.78151
491.7263 60.92105
492.2084 58.54956
492.6905 56.88928
493.1726 56.31793
493.6547 55.52777
494.1368 53.42641
494.6190 51.12054
495.1011 49.88318
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