#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-05-24 15:48:01 +0300 (Thu, 24 May 2018) $
#$Revision: 781 $
#$URL: svn://172.16.1.111/rod/cif/1/00/02/1000278.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_1000278
loop_
_publ_author_name
'Yang, H.'
'Pinch, W. W.'
'Downs, R. T.'
_publ_section_title
;
 Crystal structure of argentopyrite, AgFe2S3, and its relationship with
 cubanite Locality: Joachimstal, Bohemia, Czech Republic, type sample
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1727
_journal_page_last               1730
_journal_volume                  94
_journal_year                    2009
_chemical_compound_source        R090026
_chemical_formula_sum            'Ag Fe2 S3'
_chemical_name_mineral           Argentopyrite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2n'
_symmetry_space_group_name_H-M   'P 1 1 21/n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90.2420
_cell_length_a                   6.6902
_cell_length_b                   11.4497
_cell_length_c                   6.4525
_cell_volume                     494.262
_exptl_crystal_density_diffrn    4.243
_cod_database_code               9013697
_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            R090026.rod
_rod_data_source.block           3500000
_rod_database.code               1000278
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 9013697 COD http://www.crystallography.net/cod/9013697.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
155.0476 0.0000000E+00
155.5297 1.724854
156.0118 3.166199
156.4939 4.047180
156.9761 2.970337
157.4582 0.8125000
157.9403 7.5805999E-02
158.4224 9.4665997E-02
158.9045 0.4389040
159.3866 2.433167
159.8688 4.056396
160.3509 4.363525
160.8330 3.695374
161.3151 3.654785
161.7972 5.475098
162.2793 7.785706
162.7615 9.543884
163.2436 10.43750
163.7257 10.76508
164.2078 10.38800
164.6899 9.466309
165.1720 8.602844
165.6541 8.044617
166.1363 7.884155
166.6184 8.262024
167.1005 9.996033
167.5826 11.56281
168.0647 11.87170
168.5468 11.00592
169.0290 10.21771
169.5111 10.52545
169.9932 11.32458
170.4753 11.81445
170.9574 11.76355
171.4395 11.34393
171.9217 10.34052
172.4038 8.670166
172.8859 7.054443
173.3680 5.637329
173.8501 4.650696
174.3322 4.480347
174.8144 6.360535
175.2965 8.715210
175.7786 9.462646
176.2607 8.572876
176.7428 7.204712
177.2249 6.251038
177.7071 5.873962
178.1892 6.854553
178.6713 7.752747
179.1534 8.003967
179.6355 8.602539
180.1176 9.937622
180.5998 10.95612
181.0819 11.18719
181.5640 10.98413
182.0461 10.57605
182.5282 10.17340
183.0103 9.802368
183.4925 9.352112
183.9746 8.794861
184.4567 8.401794
184.9388 9.199219
185.4209 10.94580
185.9030 11.82861
186.3852 10.28674
186.8673 7.100647
187.3494 4.904053
187.8315 3.857849
188.3136 3.670227
188.7957 4.332581
189.2779 5.762268
189.7600 6.854614
190.2421 7.047302
190.7242 6.597046
191.2063 5.818359
191.6884 5.186951
192.1706 4.902588
192.6527 5.449646
193.1348 6.378174
193.6169 7.639221
194.0990 8.465576
194.5811 8.824829
195.0633 8.659119
195.5454 7.859863
196.0275 6.700562
196.5096 5.549255
196.9917 4.362488
197.4738 3.587219
197.9560 3.824890
198.4381 5.203552
198.9202 5.536316
199.4023 4.822815
199.8844 3.404968
200.3665 1.525879
200.8487 1.206177
201.3308 0.3315012
201.8129 2.566650
202.2950 5.2795000E-02
202.7771 1.867798
203.2592 2.700806
203.7414 2.773071
204.2235 2.299011
204.7056 0.9948120
205.1877 0.2146000
205.6698 1.061707
206.1519 3.985657
206.6341 5.360779
207.1162 4.500000
207.5983 2.497009
208.0804 1.968262
208.5625 3.379333
209.0446 4.841187
209.5268 5.380554
210.0089 4.836914
210.4910 4.199036
210.9731 3.437866
211.4552 2.639587
211.9373 1.963440
212.4195 1.336853
212.9016 1.194702
213.3837 1.502258
213.8658 2.321594
214.3479 3.459106
214.8300 5.164917
215.3121 7.053833
215.7943 8.076233
216.2764 7.851868
216.7585 7.594299
217.2406 7.906189
217.7227 9.042542
218.2048 9.845337
218.6870 10.30969
219.1691 10.36974
219.6512 10.17554
220.1333 9.434082
220.6154 8.407104
221.0975 7.029846
221.5797 4.969360
222.0618 3.591797
222.5439 3.068665
223.0260 3.161621
223.5081 3.481567
223.9902 4.571655
224.4724 4.956299
224.9545 3.591614
225.4366 1.077332
225.9187 2.806946
226.4008 7.8979000E-02
226.8829 4.873657
227.3651 7.221619
227.8472 5.875183
228.3293 3.764771
228.8114 1.853882
229.2935 5.1270001E-02
229.7757 1.114258
230.2578 0.9036870
230.7399 6.7443997E-02
231.2220 1.3550000E-02
231.7041 1.466003
232.1862 2.428528
232.6684 1.957703
233.1505 3.047014
233.6326 2.468323
234.1147 3.665771
234.5968 4.226135
235.0789 4.110107
235.5611 2.757080
236.0432 1.642151
236.5253 1.376648
237.0074 2.363831
237.4895 2.720276
237.9716 2.029053
238.4538 0.9635010
238.9359 0.7091670
239.4180 2.062866
239.9001 2.918457
240.3822 2.359192
240.8643 0.1793210
241.3465 1.410217
241.8286 0.6850590
242.3107 0.8862920
242.7928 1.739197
243.2749 1.614624
243.7570 1.194641
244.2392 0.5247800
244.7213 0.5316160
245.2034 0.9838260
245.6855 0.4326780
246.1676 0.4016110
246.6497 0.5460210
247.1319 0.5296020
247.6140 1.312927
248.0961 1.430969
248.5782 0.8344120
249.0603 8.5083000E-02
249.5424 1.738159
250.0246 3.349060
250.5067 3.972229
250.9888 2.928772
251.4709 2.251587
251.9530 2.452393
252.4351 3.579834
252.9173 4.705811
253.3994 6.242188
253.8815 7.308350
254.3636 6.692444
254.8457 2.877075
255.3278 0.7684330
255.8100 1.913452
256.2921 6.199524
256.7742 8.754333
257.2563 8.990601
257.7384 8.263306
258.2205 7.631226
258.7026 7.046143
259.1848 6.372009
259.6669 5.736328
260.1490 5.285461
260.6311 4.963501
261.1132 4.894043
261.5953 4.601807
262.0775 3.444946
262.5596 0.5726930
263.0417 0.6457520
263.5238 0.9937130
264.0059 4.681763
264.4880 6.244202
264.9702 4.819458
265.4523 2.855164
265.9344 1.990601
266.4165 2.649109
266.8986 2.920044
267.3807 2.528687
267.8629 1.684998
268.3450 1.081055
268.8271 0.7637330
269.3092 0.5759890
269.7913 0.4612430
270.2734 0.4481810
270.7556 0.3984380
271.2377 0.3407590
271.7198 0.2713010
272.2019 0.1373290
272.6840 8.0994003E-02
273.1661 0.2621460
273.6483 0.3291020
274.1304 0.2650150
274.6125 0.2265010
275.0946 0.2235110
275.5767 0.2572630
276.0588 0.5740360
276.5410 1.405884
277.0231 1.389709
277.5052 3.344789
277.9873 4.123047
278.4694 6.834473
278.9515 8.488037
279.4337 9.306824
279.9158 9.495300
280.3979 9.017578
280.8800 8.217773
281.3621 6.980347
281.8442 5.420044
282.3264 4.744263
282.8085 5.087097
283.2906 5.768860
283.7727 6.285767
284.2548 6.927490
284.7369 7.480652
285.2191 7.882874
285.7012 8.118042
286.1833 7.944519
286.6654 7.268494
287.1475 6.771118
287.6296 7.509277
288.1118 9.388000
288.5939 10.51843
289.0760 9.996338
289.5581 8.599548
290.0402 8.841187
290.5223 10.86731
291.0045 13.00922
291.4866 13.67175
291.9687 13.08643
292.4508 12.32129
292.9329 11.44269
293.4150 10.66827
293.8972 10.42566
294.3793 10.68646
294.8614 11.06451
295.3435 11.40045
295.8256 11.66437
296.3077 11.60315
296.7899 11.00732
297.2720 10.62720
297.7541 11.81586
298.2362 14.24902
298.7183 16.48242
299.2004 17.49323
299.6826 17.86121
300.1647 18.54285
300.6468 19.60590
301.1289 20.57715
301.6110 20.51300
302.0931 19.90698
302.5753 20.04895
303.0574 22.31335
303.5395 25.39703
304.0216 27.66333
304.5037 29.07190
304.9858 29.62225
305.4680 28.35590
305.9501 26.40564
306.4322 25.70819
306.9143 28.01501
307.3964 31.07849
307.8785 32.83856
308.3607 33.40576
308.8428 33.88654
309.3249 34.87671
309.8070 36.23895
310.2891 37.75476
310.7712 38.99426
311.2534 40.86230
311.7355 44.62604
312.2176 49.76154
312.6997 54.21375
313.1818 55.99707
313.6639 57.07843
314.1461 59.16943
314.6282 63.14404
315.1103 66.96271
315.5924 69.56439
316.0745 71.26648
316.5566 72.77148
317.0388 74.64539
317.5209 76.17529
318.0030 76.98163
318.4851 76.98535
318.9672 76.42682
319.4493 75.14777
319.9315 73.43213
320.4136 71.63538
320.8957 70.17572
321.3778 68.38177
321.8599 65.87994
322.3420 62.59766
322.8242 59.26300
323.3063 55.79968
323.7884 52.45587
324.2705 49.44757
324.7526 47.27594
325.2347 44.92621
325.7169 41.72327
326.1990 37.80634
326.6811 35.32007
327.1632 35.35992
327.6453 36.22229
328.1274 36.96637
328.6096 37.42902
329.0917 37.95349
329.5738 38.49872
330.0559 39.10132
330.5380 39.84491
331.0201 40.02710
331.5023 41.12164
331.9844 43.96844
332.4665 49.76587
332.9486 54.24316
333.4307 56.62378
333.9128 58.05859
334.3950 60.54218
334.8771 64.89984
335.3592 68.86578
335.8413 71.54938
336.3234 72.80573
336.8055 74.56140
337.2877 77.44098
337.7698 79.92426
338.2519 80.28992
338.7340 78.23773
339.2161 75.17230
339.6982 71.20013
340.1803 66.43329
340.6624 61.91669
341.1446 57.78302
341.6267 53.30060
342.1088 47.32056
342.5909 39.80255
343.0730 33.54443
343.5551 29.16241
344.0373 26.03210
344.5194 23.02692
345.0015 20.10773
345.4836 17.55542
345.9657 15.15656
346.4478 13.13983
346.9300 13.14142
347.4121 15.71478
347.8942 18.64771
348.3763 18.59814
348.8584 16.03223
349.3405 13.69458
349.8227 12.95624
350.3048 13.27582
350.7869 13.64014
351.2690 14.02557
351.7511 14.35950
352.2332 14.18494
352.7154 13.92755
353.1975 14.53711
353.6796 16.65247
354.1617 19.40491
354.6438 21.88190
355.1259 24.12671
355.6081 26.44354
356.0902 28.92700
356.5723 31.51898
357.0544 34.30670
357.5365 37.55475
358.0186 40.27679
358.5008 41.12848
358.9829 40.92859
359.4650 41.44580
359.9471 43.81366
360.4292 46.92377
360.9113 50.20587
361.3935 53.56482
361.8756 56.90637
362.3577 60.17755
362.8398 63.42194
363.3219 66.68854
363.8040 69.47046
364.2862 72.80603
364.7683 77.07141
365.2504 82.28070
365.7325 87.98743
366.2146 94.91180
366.6967 101.8351
367.1789 108.0016
367.6610 112.8370
368.1431 117.5084
368.6252 121.6651
369.1073 125.6971
369.5894 130.7910
370.0716 139.5348
370.5537 146.7156
371.0358 150.3454
371.5179 149.3010
372.0000 148.1412
372.4821 147.4028
372.9643 146.2549
373.4464 143.4369
373.9285 138.4257
374.4106 132.4201
374.8927 125.5059
375.3748 117.7122
375.8570 110.0300
376.3391 102.2427
376.8212 94.87390
377.3033 88.42596
377.7854 83.07605
378.2675 77.23767
378.7497 70.14587
379.2318 62.93506
379.7139 58.73389
380.1960 57.81451
380.6781 57.01239
381.1602 54.21051
381.6424 49.80164
382.1245 46.30054
382.6066 43.98267
383.0887 41.84045
383.5708 37.97235
384.0529 32.86389
384.5351 28.56152
385.0172 26.40601
385.4993 25.38275
385.9814 23.60638
386.4635 21.12500
386.9456 18.67096
387.4278 16.72772
387.9099 15.33081
388.3920 14.47668
388.8741 14.38354
389.3562 14.22009
389.8383 13.06189
390.3205 11.22308
390.8026 9.605408
391.2847 8.882690
391.7668 8.497742
392.2489 8.003540
392.7310 7.297729
393.2132 6.434509
393.6953 5.277832
394.1774 4.077759
394.6595 3.118530
395.1416 2.524414
395.6237 2.167175
396.1059 2.158081
396.5880 2.461670
397.0701 2.535950
397.5522 1.861938
398.0343 1.206177
398.5164 1.041504
398.9986 0.7861001
399.4807 0.9800295
399.9628 1.421692
400.4449 1.524841
400.9270 3.286255
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401.8913 2.710938
402.3734 2.183716
402.8555 1.659058
403.3376 0.6787720
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404.3018 2.978210
404.7840 3.710510
405.2661 2.995483
405.7482 2.463379
406.2303 2.577271
406.7124 1.751378
407.1945 2.524170
407.6767 0.6743770
408.1588 0.8323970
408.6409 0.4599000
409.1230 1.610474
409.6051 2.544678
410.0872 1.932312
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417.3190 1.222656
417.8011 5.1635999E-02
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429.8540 3.130092
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432.2646 0.7803960
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438.5321 5.3649999E-02
439.0142 1.449829
439.4963 2.110718
439.9785 1.088867
440.4606 8.6852998E-02
440.9427 0.8322140
441.4248 2.791504
441.9069 4.374695
442.3890 4.784363
442.8712 4.591431
443.3533 4.121765
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444.3175 2.523376
444.7996 2.139790
445.2817 0.4292600
445.7639 1.195679
446.2460 0.5423580
446.7281 0.1217650
447.2102 0.6347660
447.6923 0.9730220
448.1744 0.9806520
448.6566 8.8623002E-02
449.1387 0.5944210
449.6208 0.5411380
450.1029 0.4990230
450.5850 1.619995
451.0671 3.012756
451.5493 4.267883
452.0314 4.680359
452.5135 4.018860
452.9956 3.571472
453.4777 3.835388
453.9598 4.557434
454.4420 4.592896
454.9241 3.890137
455.4062 3.086060
455.8883 2.669312
456.3704 2.561096
456.8525 2.463562
457.3347 2.398010
457.8168 2.153015
458.2989 0.8804320
458.7810 0.9511720
459.2631 1.743347
459.7452 0.2987670
460.2274 3.081543
460.7095 4.221008
461.1916 3.905151
461.6737 3.298035
462.1558 2.913391
462.6379 2.648743
463.1201 2.436157
463.6022 2.307678
464.0843 2.102661
464.5664 1.542786
465.0485 0.8978270
465.5306 0.6021120
466.0128 1.026794
466.4949 1.533813
466.9770 2.144775
467.4591 2.856384
467.9412 2.717163
468.4233 0.3871460
468.9055 1.637756
469.3876 1.755981
469.8697 1.576477
470.3518 3.350281
470.8339 2.732239
471.3160 1.048462
471.7982 0.7345580
472.2803 2.127258
472.7624 3.478577
473.2445 4.208008
473.7266 4.395020
474.2087 4.384583
474.6909 4.117310
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