#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 11:16:09 +0300 (Thu, 07 Jun 2018) $
#$Revision: 1044 $
#$URL: svn://172.16.1.111/rod/cif/1/00/04/1000496.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_1000496
loop_
_publ_author_name
'Brosset, C.'
_publ_section_title
;
 Die kristallstruktur des chioliths
;
_journal_name_full
'Zeitschrift fur Anorganische und Allgemeine Chemie'
_journal_page_first              201
_journal_page_last               208
_journal_volume                  238
_journal_year                    1938
_chemical_compound_source        R050412
_chemical_formula_sum            'Al3 F14 Na5'
_chemical_name_mineral           Chiolite
_space_group_IT_number           128
_symmetry_space_group_name_Hall  '-P 4 2n'
_symmetry_space_group_name_H-M   'P 4/m n c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.00
_cell_length_b                   7.00
_cell_length_c                   10.39
_cell_volume                     509.110
_exptl_crystal_density_diffrn    3.013
_cod_original_formula_sum        'Na5 Al3 F14'
_cod_database_code               9009786
_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            R050412.rod
_rod_data_source.block           3500000
_rod_database.code               1000496
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 9009786 COD http://www.crystallography.net/cod/9009786.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
93.79987 0.0000000E+00
94.28198 0.4865640
94.76410 0.8561490
95.24622 0.8383650
95.72833 0.5449150
96.21045 0.6805780
96.69257 1.201422
97.17468 1.536362
97.65680 1.559996
98.13892 0.8591740
98.62103 0.2937030
99.10315 2.5420999E-02
99.58527 1.0421000E-02
100.0674 7.6568000E-02
100.5495 0.2897470
101.0316 0.4666130
101.5137 0.4089570
101.9958 8.0095999E-02
102.4780 0.3627130
102.9601 0.8836970
103.4422 1.493827
103.9243 2.085964
104.4064 2.604173
104.8885 3.143674
105.3707 3.906789
105.8528 4.949066
106.3349 6.123392
106.8170 7.377346
107.2991 8.770975
107.7813 10.13194
108.2634 11.48681
108.7455 12.82041
109.2276 14.02226
109.7097 14.89167
110.1918 15.78804
110.6740 16.86224
111.1561 18.52100
111.6382 19.90462
112.1203 20.79952
112.6024 21.29957
113.0845 21.90747
113.5667 22.85983
114.0488 23.85565
114.5309 24.70567
115.0130 25.10456
115.4951 25.59030
115.9772 26.38713
116.4594 27.49700
116.9415 28.55204
117.4236 29.29985
117.9057 29.96135
118.3878 30.76835
118.8699 32.26690
119.3521 33.60342
119.8342 34.14075
120.3163 33.76202
120.7984 33.45065
121.2805 33.69184
121.7626 34.41308
122.2448 35.49044
122.7269 37.74345
123.2090 39.89806
123.6911 40.57963
124.1732 39.46296
124.6553 37.62857
125.1375 35.72339
125.6196 33.83318
126.1017 32.22997
126.5838 31.12131
127.0659 30.40253
127.5480 29.90693
128.0302 29.65130
128.5123 29.51712
128.9944 29.34261
129.4765 29.13545
129.9586 28.96720
130.4407 29.04016
130.9229 29.24015
131.4050 29.04413
131.8871 28.18907
132.3692 27.02952
132.8513 26.38149
133.3334 26.18130
133.8156 25.96511
134.2977 25.52731
134.7798 25.06891
135.2619 24.83111
135.7440 24.93153
136.2261 25.28601
136.7083 25.46605
137.1904 25.39253
137.6725 25.39931
138.1546 26.01320
138.6367 27.43692
139.1188 28.36579
139.6010 28.42562
140.0831 27.62126
140.5652 26.69095
141.0473 25.66935
141.5294 24.47070
142.0115 22.87222
142.4937 20.48173
142.9758 18.56931
143.4579 17.56975
143.9400 17.68183
144.4221 17.73420
144.9042 17.73010
145.3864 17.66427
145.8685 17.52309
146.3506 17.27955
146.8327 16.99682
147.3148 16.68921
147.7969 16.34307
148.2791 16.00076
148.7612 15.57915
149.2433 15.16801
149.7254 14.97498
150.2075 15.10644
150.6896 15.36251
151.1718 15.68875
151.6539 16.31479
152.1360 16.59543
152.6181 16.23686
153.1002 15.48328
153.5823 15.06189
154.0645 15.47707
154.5466 15.90764
155.0287 15.97008
155.5108 15.45619
155.9929 14.78141
156.4750 13.91367
156.9572 12.90342
157.4393 11.96448
157.9214 10.96232
158.4035 10.12494
158.8856 9.596317
159.3677 9.911285
159.8499 10.05585
160.3320 9.601692
160.8141 8.651814
161.2962 7.820179
161.7783 7.312538
162.2604 7.025158
162.7426 6.872341
163.2247 7.241196
163.7068 7.379688
164.1889 6.745197
164.6710 5.404018
165.1531 4.257912
165.6353 3.882904
166.1174 3.887833
166.5995 3.851753
167.0816 3.471668
167.5637 3.113983
168.0458 3.021515
168.5280 3.196976
169.0101 3.484249
169.4922 3.899273
169.9743 4.339462
170.4564 4.657875
170.9385 4.736336
171.4207 4.702736
171.9028 4.585876
172.3849 4.375847
172.8670 4.335876
173.3491 4.952034
173.8312 5.877193
174.3134 6.448269
174.7955 5.990086
175.2776 5.175640
175.7597 4.769581
176.2418 4.819706
176.7239 5.173286
177.2061 5.882847
177.6882 6.818466
178.1703 7.611362
178.6524 7.904911
179.1345 7.996315
179.6166 8.427967
180.0988 9.282875
180.5809 10.22166
181.0630 10.85362
181.5451 11.23968
182.0272 11.59366
182.5093 11.87721
182.9915 12.22128
183.4736 12.93097
183.9557 14.04189
184.4378 15.48211
184.9199 17.53037
185.4020 20.01880
185.8842 22.02996
186.3663 22.74255
186.8484 22.49728
187.3305 22.46146
187.8126 22.71217
188.2947 23.22029
188.7769 23.98114
189.2590 24.98895
189.7411 26.12258
190.2232 27.37682
190.7053 28.72644
191.1874 30.03396
191.6696 31.29330
192.1517 32.52756
192.6338 33.77715
193.1159 35.04142
193.5980 36.34439
194.0801 37.72161
194.5623 39.16019
195.0444 40.59320
195.5265 42.03639
196.0086 43.42245
196.4907 44.56838
196.9728 45.44895
197.4550 46.29774
197.9371 47.22510
198.4192 48.23005
198.9013 49.40989
199.3834 50.89954
199.8655 52.43439
200.3477 53.37072
200.8298 53.64527
201.3119 53.58384
201.7940 53.35944
202.2761 52.97262
202.7582 52.43346
203.2404 51.75552
203.7225 50.91899
204.2046 49.84476
204.6867 48.50142
205.1688 47.02599
205.6509 45.44915
206.1331 43.71337
206.6152 42.23644
207.0973 41.15253
207.5794 40.33044
208.0615 39.22849
208.5436 37.65134
209.0258 36.22120
209.5079 35.46645
209.9900 35.60783
210.4721 35.39347
210.9542 34.58076
211.4363 33.37209
211.9185 32.48653
212.4006 31.99075
212.8827 31.70900
213.3648 31.54618
213.8469 31.50006
214.3290 31.63023
214.8112 31.95596
215.2933 32.41486
215.7754 32.88812
216.2575 33.42498
216.7396 33.93377
217.2217 34.38462
217.7039 34.86121
218.1860 34.94307
218.6681 34.48084
219.1502 33.62787
219.6323 32.99791
220.1144 32.83986
220.5966 32.51666
221.0787 31.62715
221.5608 29.98403
222.0429 28.25526
222.5250 26.39848
223.0071 24.47303
223.4893 22.82139
223.9714 21.50801
224.4535 20.38377
224.9356 19.37241
225.4177 18.54130
225.8998 17.66623
226.3820 16.67900
226.8641 15.64540
227.3462 14.80632
227.8283 14.13243
228.3104 13.68512
228.7925 13.55977
229.2747 14.01083
229.7568 14.19172
230.2389 13.98022
230.7210 13.49501
231.2031 13.09133
231.6852 12.67617
232.1674 12.47850
232.6495 12.66751
233.1316 13.53320
233.6137 14.11654
234.0958 14.23215
234.5779 14.08034
235.0601 14.24065
235.5422 14.89914
236.0243 15.60373
236.5064 16.15836
236.9885 16.51499
237.4706 16.82381
237.9528 17.05853
238.4349 17.24949
238.9170 17.47098
239.3991 17.74113
239.8812 18.01455
240.3633 18.27433
240.8455 18.52222
241.3276 18.74542
241.8097 18.90233
242.2918 19.04738
242.7739 19.32315
243.2560 19.87943
243.7382 20.33646
244.2203 20.56726
244.7024 20.58542
245.1845 20.31359
245.6666 19.57799
246.1487 18.63684
246.6309 18.00436
247.1130 17.92873
247.5951 17.75092
248.0772 17.19284
248.5593 16.08504
249.0414 15.22744
249.5236 14.78461
250.0057 14.48878
250.4878 13.87100
250.9699 12.77189
251.4520 11.62479
251.9341 10.53386
252.4163 9.451736
252.8984 8.662231
253.3805 8.359688
253.8626 8.195187
254.3447 7.621437
254.8268 6.357471
255.3090 5.243805
255.7911 4.581783
256.2732 4.437870
256.7553 4.131081
257.2374 3.547806
257.7195 2.912170
258.2017 2.533321
258.6838 2.569374
259.1659 2.487091
259.6480 2.094009
260.1301 1.374840
260.6122 0.8708880
261.0944 0.6524280
261.5765 0.5610690
262.0586 0.4288860
262.5407 0.2341460
263.0228 6.7368001E-02
263.5049 1.1230000E-02
263.9871 1.2547000E-02
264.4692 0.2278900
264.9513 0.7860030
265.4334 1.355846
265.9155 1.616985
266.3976 1.474785
266.8798 1.329933
267.3619 1.269646
267.8440 1.272938
268.3261 1.144627
268.8082 0.8176380
269.2903 0.5003590
269.7725 0.3561820
270.2546 0.3985250
270.7367 0.5746000
271.2188 0.9529880
271.7009 1.445747
272.1830 1.647404
272.6652 1.468388
273.1473 1.239346
273.6294 1.217777
274.1115 1.457901
274.5936 1.563931
275.0757 1.468262
275.5579 1.235847
276.0400 1.036842
276.5221 0.8647080
277.0042 0.7533070
277.4863 0.7589190
277.9684 0.8964690
278.4506 0.9537010
278.9327 0.9248160
279.4148 0.7981640
279.8969 0.4979670
280.3790 7.6219998E-03
280.8611 0.4659540
281.3433 0.7303310
281.8254 0.8029790
282.3075 0.8712500
282.7896 0.9489100
283.2717 1.008095
283.7538 0.9664000
284.2360 0.8173140
284.7181 0.7400670
285.2002 0.8320690
285.6823 1.077591
286.1644 1.343597
286.6465 1.631779
287.1287 1.925274
287.6108 2.200924
288.0929 2.459290
288.5750 2.714500
289.0571 2.984653
289.5392 3.256672
290.0214 3.460911
290.5035 3.589840
290.9856 3.709381
291.4677 3.858719
291.9498 4.047199
292.4319 4.337925
292.9141 4.828854
293.3962 5.393684
293.8783 5.662582
294.3604 5.629433
294.8425 5.648697
295.3246 6.039505
295.8068 6.737717
296.2889 7.538540
296.7710 8.466595
297.2531 9.398743
297.7352 10.07213
298.2173 10.51151
298.6995 10.95321
299.1816 11.57128
299.6637 12.31169
300.1458 13.02782
300.6279 13.65902
301.1100 14.34634
301.5922 15.44025
302.0743 16.80306
302.5564 17.87658
303.0385 17.94651
303.5206 17.65257
304.0027 17.96386
304.4849 19.07993
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306.8954 24.61989
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314.6093 38.54515
315.0914 38.61556
315.5735 38.80996
316.0557 39.07224
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319.4305 34.61403
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320.3947 31.14031
320.8768 29.60061
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321.8411 26.53072
322.3232 24.79318
322.8053 23.21065
323.2874 21.87533
323.7695 20.74194
324.2516 19.73482
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333.4119 18.00283
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335.8224 23.50628
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337.2688 26.39446
337.7509 27.65172
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338.7151 30.10089
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339.6794 32.27766
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340.6436 34.14130
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344.0184 43.18945
344.5005 44.68073
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346.4290 50.47330
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347.8754 55.27724
348.3575 57.63125
348.8396 60.32467
349.3217 62.90652
349.8038 65.00366
350.2859 66.73975
350.7681 68.47368
351.2502 70.29333
351.7323 71.90410
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352.6965 73.43748
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355.1071 74.22299
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356.0714 70.37867
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357.0356 64.77812
357.5177 61.21025
357.9998 57.44425
358.4819 53.78116
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360.8925 35.49477
361.3746 32.47400
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386.4447 15.79848
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388.8553 11.26580
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390.3016 9.208500
390.7838 8.543381
391.2659 7.980965
391.7480 7.441814
392.2301 6.837517
392.7122 6.079773
393.1943 5.343216
393.6765 4.698177
394.1586 4.140110
394.6407 3.666645
395.1228 3.262093
395.6049 2.948895
396.0870 2.768356
396.5692 2.794510
397.0513 2.729370
397.5334 2.443199
398.0155 2.057713
398.4976 1.729076
398.9797 1.447224
399.4619 1.247704
399.9440 1.194824
400.4261 1.286888
400.9082 1.230602
401.3903 0.9331470
401.8724 0.5742910
402.3546 0.2471010
402.8367 0.1185990
403.3188 0.2701150
403.8009 5.9578001E-02
404.2830 0.3151890
404.7651 0.3018490
405.2473 0.2457280
405.7294 0.7646060
406.2115 1.026081
406.6936 1.023258
407.1757 0.9417380
407.6578 0.7706680
408.1400 0.5480420
408.6221 0.2504500
409.1042 0.1170500
409.5863 0.2911830
410.0684 0.1455500
410.5505 0.1926350
411.0327 0.4247890
411.5148 0.5544360
411.9969 0.6880230
412.4790 1.000526
412.9611 1.369591
413.4432 1.447361
413.9254 1.126850
414.4075 0.7530250
414.8896 0.7203480
415.3717 0.9221730
415.8538 1.110065
416.3359 1.176121
416.8181 1.167896
417.3002 1.131958
417.7823 1.067150
418.2644 0.9409900
418.7465 0.6926310
419.2286 0.3900830
419.7108 8.9778997E-02
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