#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:43:17 +0300 (Thu, 07 Jun 2018) $
#$Revision: 954 $
#$URL: svn://172.16.1.111/rod/cif/1/00/04/1000421.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_1000421
loop_
_publ_author_name
'Hawthorne, F. C.'
_publ_section_title
;
 The crystal chemistry of the amphiboles: V. The structure and chemistry
 of arfvedsonite
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              346
_journal_page_last               356
_journal_volume                  14
_journal_year                    1976
_chemical_compound_source        R110049
_chemical_formula_sum
'Al0.306 Ca0.158 Fe4.52 H2 K1.414 Mg0.11 Mn0.13 Na2.428 O24 Si7.84 Ti0.094'
_chemical_name_mineral           Arfvedsonite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 104.101
_cell_angle_gamma                90
_cell_length_a                   10.007
_cell_length_b                   18.077
_cell_length_c                   5.332
_cell_volume                     935.477
_exptl_crystal_density_diffrn    3.545
_cod_original_formula_sum
'Si7.84 Al.306 Fe4.52 Ti.094 Mn.13 Mg.11 Na2.428 Ca.158 K1.414 O24 H2'
_cod_database_code               9004105
_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            R110049.rod
_rod_data_source.block           3500000
_rod_database.code               1000421
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 9004105 COD http://www.crystallography.net/cod/9004105.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
167.1487 0.0000000E+00
167.6309 1.506607
168.1130 2.259506
168.5951 0.9841310
169.0772 0.5437160
169.5593 1.015198
170.0414 0.1792600
170.5236 2.256653
171.0057 4.242218
171.4878 5.518280
171.9699 6.787140
172.4520 8.548065
172.9341 10.78021
173.4163 13.29187
173.8984 15.93613
174.3805 18.78726
174.8626 21.83237
175.3447 24.27493
175.8268 27.38272
176.3090 33.13623
176.7911 41.49017
177.2732 50.15460
177.7553 55.61697
178.2374 58.25821
178.7195 60.59955
179.2017 63.26901
179.6838 66.49167
180.1659 70.51541
180.6480 75.37466
181.1301 80.98523
181.6122 87.87970
182.0944 95.69333
182.5765 103.0250
183.0586 108.2401
183.5407 112.7179
184.0228 120.0752
184.5049 130.5711
184.9871 142.2419
185.4692 152.5502
185.9513 161.8424
186.4334 171.3876
186.9155 182.6025
187.3976 194.6919
187.8798 205.1687
188.3619 213.8526
188.8440 221.2474
189.3261 228.0067
189.8082 234.1469
190.2903 238.9007
190.7725 242.4288
191.2546 244.5152
191.7367 243.5035
192.2188 239.2760
192.7009 232.2815
193.1830 223.0032
193.6652 211.5048
194.1473 198.4704
194.6294 183.5427
195.1115 166.9511
195.5936 151.8052
196.0757 138.4200
196.5579 126.2417
197.0400 114.3282
197.5221 102.6680
198.0042 91.39996
198.4863 80.15668
198.9684 68.96619
199.4506 59.31165
199.9327 51.44025
200.4148 45.07248
200.8969 39.94351
201.3790 36.14212
201.8611 32.81763
202.3433 29.30417
202.8254 25.49365
203.3075 22.65182
203.7896 20.81082
204.2717 20.04941
204.7538 20.35352
205.2360 21.41422
205.7181 24.59103
206.2002 31.61783
206.6823 43.38141
207.1644 53.13400
207.6465 60.13583
208.1287 64.89670
208.6108 69.08719
209.0929 72.77881
209.5750 75.70316
210.0571 77.42856
210.5392 77.62421
211.0214 78.28561
211.5035 79.81464
211.9856 81.85342
212.4677 83.09949
212.9498 83.25717
213.4319 83.31573
213.9141 84.00470
214.3962 85.67245
214.8783 86.59534
215.3604 85.95349
215.8425 84.55161
216.3246 85.95029
216.8067 91.32025
217.2889 97.23349
217.7710 101.6900
218.2531 104.4188
218.7352 106.3761
219.2173 107.0715
219.6994 107.0568
220.1816 108.8959
220.6637 112.9534
221.1458 118.2220
221.6279 124.5299
222.1100 133.3727
222.5921 139.4081
223.0743 141.9727
223.5564 141.4292
224.0385 139.2910
224.5206 135.0381
225.0027 129.7494
225.4848 124.7504
225.9670 120.4453
226.4491 115.3578
226.9312 107.9670
227.4133 99.57373
227.8954 96.49960
228.3775 101.0829
228.8597 107.5732
229.3418 112.4392
229.8239 114.6452
230.3060 117.5106
230.7881 120.7886
231.2702 124.8458
231.7524 131.5799
232.2345 142.2717
232.7166 153.6604
233.1987 163.6325
233.6808 171.1915
234.1629 179.5191
234.6451 188.7394
235.1272 198.7998
235.6093 209.8980
236.0914 222.2601
236.5735 235.4426
237.0556 249.1640
237.5378 263.6286
238.0199 277.8474
238.5020 291.8307
238.9841 305.7331
239.4662 319.2218
239.9483 331.3456
240.4305 344.2785
240.9126 359.6404
241.3947 379.3817
241.8768 397.3979
242.3589 413.3248
242.8410 427.2717
243.3232 440.1230
243.8053 452.7390
244.2874 463.2425
244.7695 470.7177
245.2516 475.7534
245.7337 476.3436
246.2159 472.0813
246.6980 463.2645
247.1801 451.1115
247.6622 435.4615
248.1443 416.6740
248.6264 395.0194
249.1086 370.1430
249.5907 342.5473
250.0728 310.6450
250.5549 276.4690
251.0370 245.4228
251.5191 218.0569
252.0013 192.9795
252.4834 169.0908
252.9655 146.0098
253.4476 126.0878
253.9297 109.7113
254.4118 96.35678
254.8940 84.61996
255.3761 74.84338
255.8582 66.02527
256.3403 57.76627
256.8224 49.89297
257.3046 43.20496
257.7867 37.87314
258.2688 33.66528
258.7509 30.23590
259.2330 27.74039
259.7151 25.76645
260.1973 24.11609
260.6794 22.73682
261.1615 22.10007
261.6436 22.39502
262.1257 23.27908
262.6078 24.16580
263.0900 24.92844
263.5721 26.00269
264.0542 27.55185
264.5363 29.63940
265.0184 31.94348
265.5005 34.53485
265.9827 37.30722
266.4648 40.12296
266.9469 42.89734
267.4290 45.94980
267.9111 49.68356
268.3932 54.19611
268.8754 57.38391
269.3575 58.96466
269.8396 59.64413
270.3217 60.36859
270.8038 61.33990
271.2859 61.51889
271.7681 60.38535
272.2502 57.99936
272.7323 56.05481
273.2144 54.74017
273.6965 53.56073
274.1786 52.13464
274.6608 50.52173
275.1429 48.19876
275.6250 44.79352
276.1071 40.51773
276.5892 36.70392
277.0714 33.35297
277.5535 30.65729
278.0356 29.02072
278.5177 28.55057
278.9998 27.95523
279.4819 26.77988
279.9641 25.30847
280.4462 25.02820
280.9283 26.16388
281.4104 27.51169
281.8925 27.99756
282.3746 27.60788
282.8568 27.52457
283.3389 28.10056
283.8210 28.98981
284.3031 29.32465
284.7852 29.11963
285.2673 28.28278
285.7495 26.53770
286.2316 23.95598
286.7137 21.40417
287.1958 18.98540
287.6779 16.66234
288.1600 14.42508
288.6422 12.27568
289.1243 9.964966
289.6064 7.105560
290.0885 3.871796
290.5706 1.298706
291.0527 0.5639650
291.5349 1.649429
292.0170 1.306595
292.4991 0.3010250
292.9812 1.374130
293.4633 0.1901860
293.9454 2.370697
294.4276 3.240143
294.9097 1.985489
295.3918 0.1870570
295.8739 6.5094002E-02
296.3560 0.9388730
296.8381 1.845337
297.3203 1.832077
297.8024 1.301987
298.2845 1.128571
298.7666 1.359177
299.2487 1.635391
299.7308 1.256989
300.2130 0.5859990
300.6951 0.6712650
301.1772 2.623169
301.6593 5.226044
302.1414 6.808792
302.6235 7.367050
303.1057 7.383118
303.5878 6.837997
304.0699 6.061142
304.5520 5.694901
305.0341 6.343384
305.5162 7.123322
305.9984 7.134415
306.4805 6.428940
306.9626 5.391403
307.4447 4.053864
307.9268 2.609818
308.4089 1.411789
308.8911 0.9608920
309.3732 0.1397550
309.8553 2.313446
310.3374 5.977493
310.8195 9.477097
311.3016 11.77257
311.7838 13.64714
312.2659 15.76785
312.7480 18.19121
313.2301 21.02789
313.7122 24.59375
314.1943 28.64896
314.6765 32.62238
315.1586 36.14301
315.6407 39.57422
316.1228 43.10353
316.6049 46.67319
317.0870 50.63753
317.5692 55.14294
318.0513 60.11285
318.5334 65.41998
319.0155 70.99887
319.4976 76.92953
319.9797 83.46072
320.4619 90.69630
320.9440 97.40276
321.4261 102.7101
321.9082 107.4768
322.3903 112.4939
322.8724 118.0327
323.3546 123.7265
323.8367 129.6354
324.3188 135.7333
324.8009 141.5035
325.2830 146.6611
325.7651 151.5416
326.2473 156.3506
326.7294 161.6291
327.2115 166.2521
327.6936 169.9832
328.1757 172.9184
328.6578 175.6717
329.1400 179.3336
329.6221 181.9381
330.1042 182.6109
330.5863 180.1544
331.0684 177.7252
331.5505 175.3371
332.0327 172.9803
332.5148 170.7451
332.9969 169.3119
333.4790 167.0337
333.9611 163.1470
334.4432 157.1826
334.9254 151.4002
335.4075 145.9433
335.8896 140.6002
336.3717 135.0896
336.8538 129.4116
337.3359 123.6769
337.8180 117.9283
338.3001 112.1963
338.7823 106.4912
339.2644 100.7118
339.7465 95.30276
340.2286 90.60526
340.7107 86.61508
341.1928 83.67345
341.6750 82.05637
342.1571 81.52002
342.6392 81.34607
343.1213 81.58673
343.6034 81.93787
344.0855 82.12256
344.5677 82.15292
345.0498 82.41763
345.5319 82.98547
346.0140 83.79291
346.4961 84.45915
346.9782 85.01541
347.4604 86.39915
347.9425 90.03708
348.4246 95.14056
348.9067 98.32376
349.3888 99.06363
349.8709 98.79236
350.3531 99.03775
350.8352 99.83748
351.3173 101.3760
351.7994 104.0795
352.2815 107.2107
352.7636 109.5489
353.2458 111.1408
353.7279 112.7615
354.2100 115.1944
354.6921 118.0190
355.1742 120.5537
355.6563 122.3976
356.1385 124.1577
356.6206 126.4787
357.1027 129.2780
357.5848 132.0573
358.0669 134.8573
358.5490 137.2151
359.0312 138.6702
359.5133 139.0339
359.9954 138.7898
360.4775 138.0496
360.9596 136.9826
361.4417 135.9004
361.9239 135.0115
362.4060 134.0306
362.8881 132.8800
363.3702 131.6547
363.8523 129.7939
364.3344 127.0085
364.8166 123.5809
365.2987 119.8078
365.7808 114.9061
366.2629 110.6698
366.7450 107.9714
367.2271 106.7108
367.7093 104.7171
368.1914 100.9615
368.6735 96.76387
369.1556 92.94551
369.6377 89.54118
370.1198 86.62799
370.6020 84.29361
371.0841 82.45898
371.5662 80.87192
372.0483 79.82581
372.5304 78.69836
373.0125 77.23291
373.4947 75.38922
373.9768 73.25320
374.4589 70.38049
374.9410 67.54663
375.4231 65.90411
375.9052 65.32118
376.3874 66.39720
376.8695 70.42508
377.3516 77.27231
377.8337 78.99609
378.3158 74.41174
378.7979 68.13667
379.2801 64.82930
379.7622 64.63943
380.2443 64.46542
380.7264 63.47189
381.2085 62.03658
381.6906 61.44084
382.1728 61.71353
382.6549 62.14513
383.1370 62.79062
383.6191 63.34894
384.1012 62.08502
384.5833 58.29008
385.0655 53.99762
385.5476 52.30702
386.0297 52.56569
386.5118 52.39246
386.9939 49.89763
387.4760 46.44954
387.9582 44.24446
388.4403 43.30786
388.9224 42.31210
389.4045 39.96648
389.8866 37.01430
390.3687 34.42914
390.8509 32.54372
391.3330 31.07932
391.8151 30.17365
392.2972 29.64742
392.7793 28.72978
393.2614 26.86559
393.7436 24.58643
394.2257 22.09596
394.7078 19.14659
395.1899 16.83061
395.6720 15.83485
396.1541 15.60939
396.6363 15.27074
397.1184 14.50401
397.6005 13.68726
398.0826 12.96968
398.5647 12.38434
399.0468 11.66728
399.5290 10.87668
400.0111 9.899323
400.4932 8.624008
400.9753 6.435532
401.4574 4.783417
401.9395 4.009979
402.4217 3.920776
402.9038 3.621460
403.3859 3.006104
403.8680 2.337784
404.3501 1.762619
404.8322 1.368423
405.3144 0.6760710
405.7965 0.6320650
406.2786 1.851990
406.7607 1.471252
407.2428 0.9487760
407.7249 2.527802
408.2071 1.908493
408.6892 0.4571080
409.1713 1.584686
409.6534 1.334579
410.1355 0.6761320
410.6176 0.4893190
411.0998 0.6870420
411.5819 0.7377170
412.0640 0.4828490
412.5461 0.1306760
413.0282 1.3382000E-02
413.5103 0.1084590
413.9925 0.2759860
414.4746 0.6834870
414.9567 1.033844
415.4388 0.7429350
415.9209 1.394642
416.4030 1.404617
416.8852 2.147369
417.3673 2.556183
417.8494 2.685760
418.3315 2.151535
418.8136 1.685577
419.2957 1.916656
419.7779 2.728088
420.2600 3.340515
420.7421 3.198303
421.2242 2.845734
421.7063 2.734512
422.1884 3.302963
422.6706 3.436752
423.1527 2.176743
423.6348 0.3769230
424.1169 0.3674770
424.5990 1.332413
425.0811 2.999222
425.5633 3.848175
426.0454 3.749252
426.5275 3.691055
427.0096 3.624664
427.4917 3.631149
427.9738 3.780136
428.4560 4.109955
428.9381 4.487488
429.4202 4.778748
429.9023 5.125031
430.3844 6.306992
430.8665 8.833740
431.3487 10.64575
431.8308 10.36391
432.3129 7.814713
432.7950 5.896378
433.2771 4.680969
433.7592 4.006378
434.2414 3.886017
434.7235 4.256668
435.2056 4.341125
435.6877 3.870682
436.1698 2.978958
436.6519 2.656716
437.1341 0.1875760
437.6162 1.431030
438.0983 0.9361570
438.5804 0.4708400
439.0625 1.383621
439.5446 1.543274
440.0268 1.280930
440.5089 0.4782560
440.9910 0.5199130
441.4731 0.9994350
441.9552 0.1369780
442.4373 1.274780
442.9195 1.159424
443.4016 0.2086490
443.8837 1.325668
444.3658 1.478226
444.8479 1.186737
445.3300 0.8464510
445.8122 0.3309480
446.2943 4.1122001E-02
446.7764 0.2767330
447.2585 0.7948610
447.7406 0.9717560
448.2227 0.3868560
448.7049 0.1689150
449.1870 0.4613340
449.6691 0.4402470
450.1512 0.4667050
450.6333 0.6505280
451.1154 0.7669070
451.5976 0.4943240
452.0797 0.4277340
452.5618 0.8063200
453.0439 0.2643740
453.5260 0.8415220
454.0081 1.365417
454.4903 1.215591
454.9724 1.099045
455.4545 1.323654
455.9366 1.893509
456.4187 2.995102
456.9008 4.706528
457.3830 6.495941
457.8651 7.504150
458.3472 8.009018
458.8293 8.887726
459.3114 10.61044
459.7935 12.65984
460.2757 14.36484
460.7578 15.80202
461.2399 17.41568
461.7220 19.87425
462.2041 22.42505
462.6862 24.27835
463.1684 25.19861
463.6505 25.83940
464.1326 26.53055
464.6147 27.25093
465.0968 27.97498
465.5789 28.19781
466.0611 28.61667
466.5432 29.66139
467.0253 31.25261
467.5074 32.22577
467.9895 31.83250
468.4716 31.29692
468.9538 31.24342
469.4359 32.22508
469.9180 32.49828
470.4001 31.80559
470.8822 30.57707
471.3643 29.42892
471.8465 28.34880
472.3286 27.37912
472.8107 26.71649
473.2928 26.24081
473.7749 24.85794
474.2570 22.38873
474.7392 19.78014
475.2213 17.64522
475.7034 15.96234
476.1855 14.67583
476.6676 13.85567
477.1497 13.19159
477.6319 12.34232
478.1140 11.31104
478.5961 10.11957
479.0782 8.722946
479.5603 7.209198
480.0424 5.510376
480.5246 3.677887
481.0067 2.206467
481.4888 1.549957
481.9709 1.278259
482.4530 1.111450
482.9352 0.8457490
483.4173 0.8308560
483.8994 1.704330
484.3815 2.801666
484.8636 3.101288
485.3457 1.569092
485.8279 4.5196999E-02
486.3100 0.9613490
486.7921 1.437500
487.2742 1.996582
487.7563 3.154678
488.2384 3.868805
488.7206 3.693863
489.2027 3.043762
489.6848 7.1517996E-02
490.1669 7.627960
490.6490 15.53847
491.1311 16.33636
491.6133 8.819260
492.0954 2.404922
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