#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-05-24 15:49:40 +0300 (Thu, 24 May 2018) $
#$Revision: 805 $
#$URL: svn://172.16.1.111/rod/cif/1/00/02/1000298.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_1000298
loop_
_publ_author_name
'Mills, S. J.'
'Kampf, A. R.'
'Kolitsch, U.'
'Housley, R. M.'
'Raudsepp, M.'
_publ_section_title
;
 The crystal chemistry and crystal structure of kuksite, Pb3Zn3Te6+P2O14,
 and a note on the crystal structure of yafsoanite, (Ca,Pb)3Zn(TeO6)2
;
_journal_name_full               'American Mineralogist'
_journal_page_first              933
_journal_page_last               938
_journal_paper_doi               10.2138/am.2010.3483
_journal_volume                  95
_journal_year                    2010
_chemical_compound_source
'Black Pine mine, NW of Philipsburg, Granite County, Montana, USA'
_chemical_formula_sum            'As0.404 O14 P1.594 Pb3 Te Zn3'
_chemical_name_mineral           Kuksite
_space_group_IT_number           150
_symmetry_space_group_name_Hall  'P 3 2"'
_symmetry_space_group_name_H-M   'P 3 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   8.392
_cell_length_b                   8.392
_cell_length_c                   5.204
_cell_volume                     317.394
_exptl_crystal_density_diffrn    6.535
_cod_original_formula_sum        'Pb3 Te Zn3 P1.594 As.404 O14'
_cod_database_code               9016211
_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            R110039.rod
_rod_data_source.block           3500000
_rod_database.code               1000298
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 9016211 COD http://www.crystallography.net/cod/9016211.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
195.5936 0.0000000E+00
196.0757 4.6844002E-02
196.5579 0.4781800
197.0400 0.7738040
197.5221 1.621429
198.0042 1.449677
198.4863 0.8114930
198.9684 0.3206790
199.4506 0.4692080
199.9327 0.7546390
200.4148 2.615021
200.8969 3.322571
201.3790 2.646667
201.8611 2.097076
202.3433 2.801758
202.8254 4.924133
203.3075 6.241425
203.7896 6.317657
204.2717 5.718414
204.7538 5.925079
205.2360 7.088074
205.7181 8.455017
206.2002 9.658142
206.6823 10.71573
207.1644 11.38586
207.6465 11.46225
208.1287 11.22873
208.6108 11.63281
209.0929 12.88651
209.5750 14.18637
210.0571 15.02390
210.5392 15.32825
211.0214 15.52475
211.5035 15.61884
211.9856 15.64664
212.4677 15.74127
212.9498 15.95615
213.4319 16.14423
213.9140 16.20770
214.3962 16.11411
214.8783 16.03714
215.3604 15.97501
215.8425 15.94675
216.3246 16.04276
216.8067 16.29913
217.2889 16.60095
217.7710 16.86591
218.2531 17.04880
218.7352 17.31815
219.2173 17.73010
219.6994 18.23038
220.1816 18.57706
220.6637 18.74539
221.1458 18.79639
221.6279 18.65704
222.1100 17.95612
222.5921 18.08395
223.0743 19.58301
223.5564 22.01538
224.0385 23.29037
224.5206 22.87497
225.0027 22.13501
225.4848 21.91818
225.9670 22.49265
226.4491 22.95819
226.9312 23.13956
227.4133 23.15646
227.8954 23.66202
228.3775 25.06549
228.8597 26.35895
229.3418 26.86063
229.8239 26.16635
230.3060 25.60007
230.7881 25.20755
231.2702 25.00104
231.7524 25.13705
232.2345 25.87213
232.7166 26.56436
233.1987 26.77472
233.6808 26.12857
234.1629 25.82321
234.6451 26.07806
235.1272 26.73169
235.6093 27.11823
236.0914 27.30222
236.5735 27.13376
237.0556 26.43246
237.5378 24.70901
238.0199 23.54764
238.5020 23.16537
238.9841 23.41602
239.4662 23.77805
239.9483 24.54044
240.4305 25.04666
240.9126 24.88541
241.3947 23.62195
241.8768 22.66656
242.3589 22.10114
242.8410 21.88931
243.3232 21.91629
243.8053 22.29739
244.2874 22.75760
244.7695 23.18588
245.2516 23.61142
245.7337 23.92358
246.2159 24.07159
246.6980 24.34601
247.1801 24.82382
247.6622 25.34100
248.1443 25.83093
248.6264 25.87683
249.1086 25.25876
249.5907 24.82739
250.0728 24.67386
250.5549 24.73538
251.0370 24.91803
251.5191 25.68860
252.0013 25.87656
252.4834 24.68991
252.9655 21.03564
253.4476 18.96899
253.9297 19.11856
254.4118 20.62622
254.8940 21.60364
255.3761 21.95303
255.8582 21.93500
256.3403 21.52060
256.8224 20.38660
257.3046 19.92145
257.7867 20.46964
258.2688 21.46872
258.7509 21.82568
259.2330 21.28549
259.7151 20.60925
260.1973 20.11182
260.6794 19.91223
261.1615 19.32996
261.6436 18.06036
262.1257 16.68420
262.6078 16.31125
263.0900 17.40649
263.5721 18.42236
264.0542 18.72275
264.5363 18.13254
265.0184 18.15695
265.5005 19.14386
265.9827 20.35132
266.4648 20.56235
266.9469 19.32224
267.4290 18.42072
267.9111 18.50897
268.3932 19.66107
268.8754 20.57233
269.3575 21.23868
269.8396 21.65421
270.3217 21.73511
270.8038 21.37421
271.2859 21.04965
271.7681 20.83829
272.2502 20.74118
272.7323 20.96927
273.2144 21.58966
273.6965 22.39261
274.1786 23.20209
274.6608 24.05142
275.1429 24.75928
275.6250 25.26694
276.1071 25.59305
276.5892 25.83447
277.0714 25.94052
277.5535 26.10782
278.0356 26.65073
278.5177 27.64005
278.9998 28.19849
279.4819 27.94995
279.9641 27.16937
280.4462 27.27148
280.9283 28.48917
281.4104 29.58005
281.8925 29.36490
282.3746 27.82568
282.8568 26.47766
283.3389 25.60526
283.8210 25.06592
284.3031 24.60812
284.7852 24.29150
285.2673 23.61426
285.7495 21.93561
286.2316 19.36664
286.7137 17.33557
287.1958 16.13190
287.6779 15.39703
288.1600 14.39111
288.6422 13.10748
289.1243 11.85019
289.6064 10.92535
290.0885 10.23404
290.5706 9.297577
291.0527 8.012543
291.5349 6.590210
292.0170 5.353821
292.4991 4.297424
292.9812 3.273407
293.4633 2.077789
293.9454 0.8449400
294.4276 7.8185998E-02
294.9097 0.1375120
295.3918 0.1032100
295.8739 8.7890001E-03
296.3560 8.2947001E-02
296.8381 0.1388850
297.3203 1.192444
297.8024 2.586151
298.2845 3.227570
298.7666 3.044556
299.2487 2.642700
299.7308 2.785065
300.2130 3.229034
300.6951 3.269958
301.1772 2.356415
301.6593 1.016479
302.1414 8.9050002E-02
302.6235 0.9509280
303.1057 1.556458
303.5878 1.741699
304.0699 1.671204
304.5520 1.623260
305.0341 1.470612
305.5162 1.581512
305.9984 2.402802
306.4805 3.879303
306.9626 5.671692
307.4447 7.809113
307.9268 10.03656
308.4089 12.00568
308.8911 13.65362
309.3732 14.98547
309.8553 15.70453
310.3374 16.03033
310.8195 16.72180
311.3016 18.53098
311.7838 20.72299
312.2659 22.57910
312.7480 23.68951
313.2301 25.07715
313.7122 27.63058
314.1943 30.92587
314.6765 34.02234
315.1586 36.52914
315.6407 38.68790
316.1228 40.52768
316.6049 41.90701
317.0870 43.65759
317.5692 46.48502
318.0513 49.77170
318.5334 52.63348
319.0155 54.38464
319.4976 56.13358
319.9797 58.49326
320.4619 61.51767
320.9440 64.25983
321.4261 66.30798
321.9082 67.95633
322.3903 69.47314
322.8724 71.00662
323.3546 72.33072
323.8367 73.51443
324.3188 74.56519
324.8009 75.08295
325.2830 74.43668
325.7651 73.55212
326.2473 73.02805
326.7294 73.67532
327.2115 73.81888
327.6936 73.20810
328.1757 71.94626
328.6578 70.49768
329.1400 68.74094
329.6221 66.93018
330.1042 65.14529
330.5863 63.19595
331.0684 61.64172
331.5505 60.86829
332.0327 60.42340
332.5148 59.26624
332.9969 56.74164
333.4790 54.33542
333.9611 52.54752
334.4432 51.54480
334.9254 50.44373
335.4075 49.20181
335.8896 47.88531
336.3717 46.58060
336.8538 45.28040
337.3359 44.02972
337.8180 42.78149
338.3001 41.54800
338.7823 40.83511
339.2644 40.87897
339.7465 41.01428
340.2286 40.50592
340.7107 39.22498
341.1928 38.15555
341.6750 37.55490
342.1571 37.30453
342.6392 36.96411
343.1213 36.50858
343.6034 36.09818
344.0855 35.88644
344.5677 35.86646
345.0498 35.73639
345.5319 35.39969
346.0140 35.04242
346.4961 35.17496
346.9782 35.77017
347.4604 36.12561
347.9425 35.51788
348.4246 34.29471
348.9067 33.83145
349.3888 34.29102
349.8709 35.05795
350.3531 35.44766
350.8352 35.52301
351.3173 35.52261
351.7994 35.63443
352.2815 35.69885
352.7636 35.38245
353.2458 34.68866
353.7279 33.95581
354.2100 33.38733
354.6921 32.97067
355.1742 32.70004
355.6563 33.02817
356.1385 33.02808
356.6206 31.39883
357.1027 28.48376
357.5848 25.93692
358.0669 25.05106
358.5490 24.84479
359.0312 24.42441
359.5133 23.53577
359.9954 22.63217
360.4775 22.00455
360.9596 21.50452
361.4417 20.83932
361.9239 19.85648
362.4060 18.70251
362.8881 17.38876
363.3702 15.86319
363.8523 14.50272
364.3344 13.49200
364.8166 12.68845
365.2987 11.91522
365.7808 11.41550
366.2629 10.68222
366.7450 9.330780
367.2271 7.368317
367.7093 5.986542
368.1914 5.817810
368.6735 5.954865
369.1556 5.804443
369.6377 4.890076
370.1198 4.258148
370.6020 4.161316
371.0841 4.400787
371.5662 4.246216
372.0483 3.428772
372.5304 2.540527
373.0125 1.838745
373.4947 1.447998
373.9768 0.8473210
374.4589 0.2070310
374.9410 1.284271
375.4231 1.543884
375.9052 0.5643310
376.3874 4.1687001E-02
376.8695 0.3913570
377.3516 1.824524
377.8337 2.534912
378.3158 2.402283
378.7979 1.895813
379.2801 1.401611
379.7622 0.9068300
380.2443 0.5131530
380.7264 0.1979370
381.2085 2.4323000E-02
381.6906 0.2787780
382.1728 0.9739990
382.6549 1.595978
383.1370 1.776947
383.6191 1.595856
384.1012 1.331268
384.5833 1.009064
385.0655 0.6344910
385.5476 0.2185360
386.0297 0.2410580
386.5118 0.7375490
386.9939 1.405487
387.4760 2.060913
387.9582 2.419891
388.4403 2.482056
388.9224 2.420319
389.4045 2.253235
389.8866 2.087738
390.3687 2.085083
390.8509 2.449799
391.3330 2.839661
391.8151 2.896332
392.2972 2.736633
392.7793 2.826599
393.2614 3.534515
393.7436 4.488403
394.2257 5.497101
394.7078 6.651459
395.1899 7.520691
395.6720 7.698517
396.1541 7.532898
396.6363 7.585571
397.1184 8.261047
397.6005 8.921204
398.0826 9.211426
398.5647 9.014771
399.0468 9.325470
399.5290 11.00415
400.0111 12.79709
400.4932 13.68445
400.9753 12.62198
401.4574 12.05905
401.9395 12.35754
402.4217 13.35336
402.9038 14.28259
403.3859 15.14056
403.8680 15.94177
404.3501 16.63486
404.8322 17.06778
405.3144 17.99915
405.7965 19.72391
406.2786 21.58096
406.7607 22.34570
407.2428 21.79074
407.7249 21.38953
408.2071 21.70364
408.6892 22.60248
409.1713 23.22079
409.6534 23.51578
410.1355 23.78580
410.6176 24.31570
411.0998 25.06921
411.5819 25.84662
412.0640 26.64081
412.5461 27.38583
413.0282 27.86957
413.5103 28.15805
413.9925 28.65271
414.4746 29.91995
414.9567 31.44089
415.4388 32.30286
415.9209 32.38574
416.4030 32.35074
416.8852 32.72879
417.3673 33.37106
417.8494 34.03421
418.3315 34.67761
418.8136 35.28113
419.2957 35.78705
419.7779 36.22214
420.2600 36.77756
420.7421 37.75372
421.2242 38.76016
421.7063 39.45615
422.1884 39.56140
422.6706 39.81311
423.1527 40.32474
423.6348 41.11551
424.1169 42.21500
424.5990 44.14133
425.0811 45.88788
425.5633 47.06723
426.0454 47.57483
426.5275 48.26096
427.0096 49.24561
427.4917 50.30420
427.9738 51.27664
428.4560 52.14932
428.9381 52.93866
429.4202 53.60794
429.9023 54.16635
430.3844 54.73099
430.8665 55.36786
431.3487 55.82632
431.8308 55.85489
432.3129 55.38513
432.7950 55.20779
433.2771 55.44281
433.7592 55.92505
434.2414 56.46030
434.7235 56.95755
435.2056 56.98846
435.6877 56.30484
436.1698 55.33337
436.6519 54.92871
437.1341 55.06665
437.6162 55.25357
438.0983 55.21881
438.5804 54.96002
439.0625 54.40259
439.5446 53.42075
440.0268 52.39108
440.5089 51.67642
440.9910 51.20999
441.4731 50.82635
441.9552 50.72037
442.4373 50.45523
442.9195 49.55713
443.4016 48.04080
443.8837 46.82773
444.3658 46.57410
444.8479 46.60400
445.3300 46.38434
445.8122 45.71497
446.2943 44.87299
446.7764 43.61841
447.2585 42.20459
447.7406 41.28903
448.2227 41.50208
448.7049 41.64752
449.1870 41.37473
449.6691 40.62518
450.1512 39.79193
450.6333 38.75095
451.1154 37.78510
451.5976 37.21158
452.0797 37.17862
452.5618 37.08539
453.0439 36.90799
453.5260 36.58701
454.0081 35.73026
454.4903 34.20096
454.9724 33.03369
455.4545 33.01080
455.9366 33.95132
456.4187 34.62646
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457.3830 35.05753
457.8651 34.52139
458.3472 33.61273
458.8293 33.12381
459.3114 33.57193
459.7935 34.27911
460.2757 34.33585
460.7578 33.85028
461.2399 33.39676
461.7220 33.51257
462.2041 33.72769
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463.1684 32.61612
463.6505 31.92365
464.1326 32.14932
464.6147 32.74689
465.0968 33.01312
465.5789 32.75769
466.0611 32.12949
466.5432 30.94681
467.0253 29.29364
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468.9538 26.37415
469.4359 26.39114
469.9180 26.07007
470.4001 25.27658
470.8822 24.22595
471.3643 23.20490
471.8465 22.16660
472.3286 21.28763
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473.2928 20.27185
473.7749 19.62634
474.2570 18.71246
474.7392 17.71014
475.2213 16.73938
475.7034 15.79462
476.1855 14.87735
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477.1497 13.07709
477.6319 11.67477
478.1140 9.967804
478.5961 8.450012
479.0782 7.475525
479.5603 6.719360
480.0424 5.793762
480.5246 4.719604
481.0067 3.700897
481.4888 2.852173
481.9709 2.118469
482.4530 1.443909
482.9352 0.7808230
483.4173 0.2598270
483.8994 5.5877998E-02
484.3815 6.8660001E-03
484.8636 0.1933900
485.3457 0.8849790
485.8279 1.380646
486.3100 1.350311
486.7921 0.7900390
487.2742 0.5586850
487.7563 0.8193050
488.2384 1.227692
488.7206 1.601013
489.2027 1.929626
489.6848 2.250977
490.1669 2.643585
490.6490 2.935272
491.1311 2.826050
491.6133 2.277679
492.0954 1.602325
492.5775 0.8802190
493.0596 0.1096190
493.5417 0.9052730
494.0238 2.167877
494.5060 3.013306
494.9881 2.527466
495.4702 1.254639
495.9523 0.5904540
496.4344 0.7825930
496.9165 1.270752
497.3987 1.402130
497.8808 1.437134
498.3629 1.866547
498.8450 3.441711
499.3271 5.019592
499.8092 5.854034
500.2914 6.030945
500.7735 5.971588
501.2556 5.455902
501.7377 5.054474
502.2198 5.171387
502.7019 6.143372
503.1841 6.889526
503.6662 7.003296
504.1483 6.945618
504.6304 7.277374
505.1125 8.477020
505.5946 9.259583
506.0768 9.213837
506.5589 8.574799
507.0410 8.542480
507.5231 9.216522
508.0052 10.20084
508.4873 11.35776
508.9695 12.67206
509.4516 14.11221
509.9337 15.76846
510.4158 17.15414
510.8979 17.35513
511.3800 16.68738
511.8622 16.62299
512.3443 17.78424
512.8264 19.38666
513.3085 20.35632
513.7906 20.86432
514.2728 21.52090
514.7549 22.78366
515.2370 24.27545
515.7191 25.62573
516.2012 26.79904
516.6833 28.18619
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1303.016 0.0000000E+00
