#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 14:02:09 +0300 (Thu, 26 Apr 2018) $
#$Revision: 618 $
#$URL: svn://172.16.1.111/rod/cif/2/10/00/2100014.rod $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2100014
loop_
_publ_author_name
'Prichard, P.'
'Perrault, G.'
_publ_section_title
;
 Structure cristalline de l'ekanite de St-Hilaire, P.Q.
;
_journal_name_full               'Acta Crystallographica, Section B'
_journal_page_first              1994
_journal_page_last               1999
_journal_paper_doi               10.1107/S0567740872005412
_journal_volume                  28
_journal_year                    1972
_chemical_compound_source        'Mont St-Hilaire, Quebec, Canada'
_chemical_formula_sum
'Ca0.74 Ce0.03 K0.6 Mg0.04 Mn0.2 Na0.9 O20 Pb0.01 Si8 Th0.88'
_chemical_name_mineral           Steacyite
_space_group_IT_number           124
_symmetry_space_group_name_Hall  '-P 4 2c'
_symmetry_space_group_name_H-M   'P 4/m c c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.58
_cell_length_b                   7.58
_cell_length_c                   14.77
_cell_volume                     848.631
_exptl_crystal_density_diffrn    3.291
_cod_original_formula_sum
'K.6 Na.9 Ca.74 Mn.2 Mg.04 Th.88 Ce.03 Pb.01 Si8 O20'
_cod_database_code               9015318
_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            R130053.rod
_rod_data_source.block           3500000
_rod_database.code               2100014
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 9015318 COD http://www.crystallography.net/cod/9015318.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
102.7704 0.0000000E+00
103.2525 0.6441800
103.7346 0.5168760
104.2167 1.7975001E-02
104.6988 6.8210000E-03
105.1810 0.4421540
105.6631 1.082245
106.1452 1.788010
106.6273 2.616516
107.1094 3.091080
107.5915 2.415710
108.0737 1.689255
108.5558 1.400482
109.0379 1.437149
109.5200 1.468307
110.0021 1.081421
110.4842 0.1603090
110.9664 7.5409003E-02
111.4485 0.7142030
111.9306 1.614197
112.4127 2.336166
112.8948 2.881821
113.3769 3.324829
113.8591 3.770447
114.3412 4.160416
114.8233 4.476273
115.3054 4.740509
115.7875 4.982361
116.2696 5.280029
116.7517 5.699860
117.2339 6.117828
117.7160 6.195206
118.1981 5.648575
118.6802 5.282471
119.1623 5.328735
119.6444 5.722351
120.1266 6.352829
120.6087 7.372162
121.0908 8.484650
121.5729 9.126144
122.0550 9.175369
122.5371 9.024429
123.0193 8.816116
123.5014 8.526779
123.9835 8.269882
124.4656 7.841751
124.9477 7.466278
125.4298 7.458008
125.9120 8.054871
126.3941 8.907211
126.8762 9.396271
127.3583 9.370773
127.8404 9.315643
128.3225 9.408096
128.8047 9.561295
129.2868 9.651474
129.7689 9.521790
130.2510 9.420288
130.7331 9.478027
131.2152 9.501068
131.6974 9.636459
132.1795 9.578094
132.6616 9.182678
133.1437 8.592575
133.6258 8.508911
134.1079 8.809616
134.5901 9.030716
135.0722 9.291763
135.5543 9.507126
136.0364 9.761963
136.5185 10.04437
137.0006 10.18298
137.4828 10.04036
137.9649 9.514679
138.4470 8.990906
138.9291 8.450027
139.4112 7.990158
139.8933 7.741135
140.3755 7.797195
140.8576 7.840424
141.3397 7.262512
141.8218 6.107437
142.3039 5.219421
142.7860 5.199661
143.2681 5.785934
143.7503 5.999237
144.2324 5.386688
144.7145 4.616486
145.1966 4.318390
145.6787 4.494751
146.1608 4.746338
146.6430 4.774918
147.1251 4.576141
147.6072 4.231232
148.0893 3.443710
148.5714 2.700058
149.0535 2.310501
149.5357 2.335739
150.0178 2.558029
150.4999 2.665558
150.9820 2.625381
151.4641 2.531204
151.9462 2.348953
152.4284 2.152328
152.9105 2.004578
153.3926 1.938797
153.8747 1.900375
154.3568 1.738602
154.8389 1.245789
155.3211 0.8770140
155.8032 0.8219600
156.2853 0.8520660
156.7674 0.6348270
157.2495 1.5853999E-02
157.7316 0.9341740
158.2138 1.390686
158.6959 0.8768310
159.1780 0.5424190
159.6601 0.7706760
160.1422 1.394470
160.6243 1.679779
161.1065 1.859100
161.5886 1.883636
162.0707 1.618988
162.5528 0.6607970
163.0349 0.1925200
163.5170 0.3417210
163.9991 0.1419680
164.4813 0.5531460
164.9634 0.3956760
165.4455 0.1372380
165.9276 0.5554500
166.4097 0.7343440
166.8918 0.8428040
167.3740 1.117371
167.8561 1.614700
168.3382 1.992920
168.8203 1.904724
169.3024 1.632187
169.7845 1.503265
170.2667 1.696625
170.7488 2.071564
171.2309 2.275772
171.7130 2.142105
172.1951 2.152351
172.6772 2.503815
173.1594 3.085823
173.6415 3.774986
174.1236 4.561852
174.6057 5.387947
175.0878 5.874939
175.5699 5.624695
176.0521 5.466019
176.5342 5.731079
177.0163 6.242119
177.4984 6.667183
177.9805 6.751381
178.4626 6.492836
178.9448 6.317055
179.4269 6.181763
179.9090 6.161163
180.3911 6.340851
180.8732 6.666702
181.3553 7.007263
181.8375 7.244629
182.3196 7.358238
182.8017 7.566536
183.2838 7.926498
183.7659 8.308189
184.2480 8.685608
184.7301 9.036697
185.2123 9.314842
185.6944 9.483170
186.1765 9.529099
186.6586 9.450630
187.1407 9.081833
187.6228 8.709366
188.1050 8.555618
188.5871 8.641434
189.0692 8.826683
189.5513 9.012520
190.0334 9.192848
190.5155 9.288368
190.9977 9.164078
191.4798 9.012520
191.9619 9.092323
192.4440 9.469231
192.9261 9.890877
193.4082 10.14339
193.8904 10.25620
194.3725 10.25159
194.8546 10.08289
195.3367 9.808472
195.8188 9.513664
196.3009 9.152229
196.7831 8.896469
197.2652 8.916542
197.7473 9.135696
198.2294 9.371910
198.7115 9.506783
199.1936 9.570099
199.6758 9.718201
200.1579 10.04018
200.6400 10.34123
201.1221 10.42061
201.6042 10.38277
202.0863 10.49272
202.5685 11.06769
203.0506 12.06527
203.5327 12.66621
204.0148 12.52100
204.4969 12.29991
204.9790 12.26879
205.4612 12.37080
205.9433 12.42526
206.4254 12.26896
206.9075 11.89013
207.3896 11.59967
207.8717 11.50514
208.3539 11.40987
208.8360 11.21550
209.3181 10.95790
209.8002 10.74404
210.2823 10.67900
210.7644 10.78370
211.2466 10.86003
211.7287 10.89835
212.2108 10.92012
212.6929 10.87904
213.1750 10.81236
213.6571 10.85480
214.1393 11.18125
214.6214 11.91039
215.1035 11.94173
215.5856 10.73153
216.0677 9.438828
216.5498 8.672943
217.0320 8.417435
217.5141 8.332031
217.9962 8.142502
218.4783 7.864784
218.9604 7.450989
219.4425 6.594849
219.9247 5.895599
220.4068 5.899384
220.8889 6.541718
221.3710 7.191116
221.8531 7.313370
222.3352 6.855591
222.8174 6.427490
223.2995 6.059525
223.7816 5.718323
224.2637 5.390030
224.7458 5.070755
225.2279 4.755814
225.7100 4.463837
226.1922 4.174728
226.6743 3.784134
227.1564 3.090500
227.6385 2.412277
228.1206 2.057617
228.6027 2.047485
229.0849 2.216873
229.5670 2.613449
230.0491 3.095154
230.5312 3.265015
231.0133 2.709976
231.4954 2.009064
231.9776 1.904510
232.4597 2.484573
232.9418 3.038910
233.4239 2.973511
233.9060 2.610245
234.3881 2.435043
234.8703 2.605042
235.3524 2.985489
235.8345 3.454880
236.3166 4.062195
236.7987 4.558670
237.2808 4.738419
237.7630 4.761780
238.2451 4.799942
238.7272 4.927643
239.2093 5.061035
239.6914 5.026459
240.1735 4.742371
240.6557 4.554367
241.1378 4.765182
241.6199 5.064041
242.1020 5.083527
242.5841 4.623596
243.0662 4.071213
243.5484 4.144684
244.0305 5.072327
244.5126 6.011536
244.9947 6.882553
245.4768 7.587158
245.9589 7.976212
246.4410 7.987976
246.9232 7.825760
247.4053 7.859207
247.8874 8.206070
248.3695 8.465652
248.8516 8.475891
249.3337 8.433350
249.8159 8.504166
250.2980 8.737732
250.7801 9.031448
251.2622 9.235916
251.7443 9.385590
252.2264 9.340164
252.7086 8.805649
253.1907 8.283371
253.6728 8.075516
254.1549 8.277573
254.6370 8.858902
255.1191 9.935349
255.6013 12.22780
256.0834 13.37723
256.5655 12.65480
257.0476 11.50626
257.5297 10.81396
258.0118 10.76505
258.4940 11.03629
258.9761 11.21249
259.4582 11.28838
259.9403 11.26752
260.4224 11.06180
260.9045 10.85422
261.3867 10.75453
261.8688 10.77287
262.3509 10.84354
262.8330 10.88812
263.3151 10.87767
263.7972 10.95561
264.2794 11.21213
264.7615 11.46364
265.2436 11.59822
265.7257 11.61998
266.2078 11.61400
266.6899 11.67323
267.1721 11.82715
267.6542 11.83525
268.1363 11.61281
268.6184 11.35443
269.1005 11.17331
269.5826 11.07262
270.0648 10.96130
270.5469 10.75264
271.0290 10.42366
271.5111 10.19077
271.9932 10.23517
272.4753 10.17876
272.9575 9.764542
273.4396 9.121338
273.9217 8.581650
274.4038 8.370850
274.8859 8.466812
275.3680 8.627243
275.8501 9.140991
276.3322 9.386032
276.8144 8.982025
277.2965 8.135406
277.7786 7.300735
278.2607 6.719162
278.7428 6.360535
279.2249 6.092743
279.7071 5.978622
280.1892 5.857330
280.6713 5.669891
281.1534 5.444839
281.6355 5.255936
282.1176 5.151917
282.5998 5.065811
283.0819 4.761856
283.5640 3.836655
284.0461 3.441803
284.5282 4.427658
285.0103 5.915482
285.4925 6.493866
285.9746 5.629028
286.4567 4.133179
286.9388 3.437302
287.4209 3.774414
287.9030 4.062820
288.3852 4.064117
288.8673 3.975571
289.3494 4.061081
289.8315 4.406937
290.3136 4.722198
290.7957 4.577591
291.2779 3.895599
291.7600 3.342468
292.2421 3.128540
292.7242 2.989227
293.2063 2.543564
293.6884 1.753769
294.1706 1.160324
294.6527 1.400055
295.1348 2.480164
295.6169 3.071945
296.0990 2.829956
296.5811 2.301849
297.0633 1.785110
297.5454 1.324478
298.0275 1.091980
298.5096 1.300049
298.9917 1.860535
299.4738 2.154129
299.9560 1.947998
300.4381 1.690796
300.9202 1.718201
301.4023 1.951889
301.8844 1.987991
302.3665 1.510696
302.8487 0.7705540
303.3308 0.5259400
303.8129 1.035172
304.2950 1.559860
304.7771 1.706970
305.2592 1.613937
305.7414 1.658676
306.2235 2.019760
306.7056 2.515335
307.1877 2.775757
307.6698 2.762344
308.1519 2.743210
308.6341 2.830841
309.1162 2.963120
309.5983 3.020477
310.0804 2.961792
310.5625 2.871002
311.0446 2.919571
311.5268 3.130615
312.0089 3.092789
312.4910 2.402252
312.9731 1.569351
313.4552 1.218933
313.9373 1.449234
314.4195 1.939743
314.9016 2.521271
315.3837 3.163071
315.8658 3.501404
316.3479 3.293640
316.8300 2.921387
317.3121 2.702820
317.7943 2.638489
318.2764 2.546432
318.7585 2.284668
319.2406 1.897491
319.7227 1.610214
320.2048 1.521835
320.6870 1.431839
321.1691 1.186661
321.6512 0.8379820
322.1333 0.5540920
322.6154 0.3978420
323.0975 0.3786770
323.5797 0.5522610
324.0618 1.078232
324.5439 1.431152
325.0260 1.378784
325.5081 1.035355
325.9902 0.5783540
326.4724 3.5202000E-02
326.9545 0.5097350
327.4366 0.9677280
327.9187 1.394470
328.4008 1.505341
328.8829 0.9254000
329.3651 0.1497800
329.8472 0.2384640
330.3293 0.1383970
330.8114 0.1878510
331.2935 0.5216220
331.7756 0.8636020
332.2578 1.166992
332.7399 1.505478
333.2220 1.748322
333.7041 1.768478
334.1862 1.581589
334.6683 1.312973
335.1505 1.016495
335.6326 0.7154080
336.1147 0.5605470
336.5968 0.6720730
337.0789 0.7814790
337.5610 0.7778020
338.0432 0.6850740
338.5253 0.5388180
339.0074 0.3318790
339.4895 0.1344150
339.9716 0.1675110
340.4537 0.5883180
340.9359 0.9161220
341.4180 1.052231
341.9001 1.048889
342.3822 0.9959720
342.8643 0.9200740
343.3464 0.7064970
343.8286 0.1160890
344.3107 1.196564
344.7928 1.768280
345.2749 0.8625180
345.7570 0.2874150
346.2391 0.6834410
346.7213 0.2872470
347.2034 0.2697450
347.6855 0.4155270
348.1676 0.1220090
348.6497 4.0725999E-02
349.1318 0.3760830
349.6140 0.6818850
350.0961 0.6517490
350.5782 0.4374850
351.0603 0.4254910
351.5424 0.8601680
352.0245 1.625610
352.5067 2.231155
352.9888 2.550797
353.4709 2.865921
353.9530 3.200760
354.4351 3.550583
354.9172 3.917099
355.3994 4.299026
355.8815 4.678574
356.3636 5.022034
356.8457 5.257309
357.3278 5.611008
357.8099 6.290924
358.2920 6.923767
358.7741 7.161850
359.2563 7.039078
359.7384 6.904221
360.2205 7.101929
360.7026 7.664352
361.1847 8.258179
361.6668 9.057022
362.1490 9.706131
362.6311 9.868790
363.1132 9.811752
363.5953 10.05725
364.0774 10.94611
364.5595 12.30887
365.0417 13.41911
365.5238 14.04431
366.0059 14.72072
366.4880 15.62820
366.9701 16.55258
367.4522 17.22253
367.9344 17.56679
368.4165 17.83403
368.8986 18.44540
369.3807 19.57536
369.8628 20.57391
370.3449 21.34428
370.8271 22.05426
371.3092 22.79785
371.7913 23.57135
372.2734 24.32639
372.7555 25.00253
373.2376 25.60291
373.7198 26.25368
374.2019 26.81648
374.6840 27.63042
375.1661 28.87888
375.6482 30.41687
376.1303 32.04088
376.6125 33.69344
377.0946 35.30293
377.5767 36.66797
378.0588 37.65306
378.5409 38.77739
379.0230 40.40274
379.5052 42.08865
379.9873 43.44582
380.4694 44.40051
380.9515 45.28777
381.4336 46.46118
381.9157 47.91556
382.3979 49.30698
382.8800 50.57513
383.3621 51.78448
383.8442 52.94290
384.3263 54.06491
384.8084 55.24615
385.2906 56.54817
385.7727 57.94254
386.2548 59.43323
386.7369 61.10367
387.2190 62.71925
387.7011 64.11319
388.1833 65.32973
388.6654 66.40305
389.1475 67.25673
389.6296 68.12045
390.1117 69.23817
390.5938 70.57890
391.0760 71.90070
391.5581 73.21257
392.0402 74.39052
392.5223 75.27199
393.0044 75.86494
393.4865 76.28259
393.9687 76.36389
394.4508 76.34070
394.9329 76.63937
395.4150 77.35004
395.8971 78.17268
396.3792 78.96263
396.8614 79.66904
397.3435 79.94836
397.8256 79.32930
398.3077 78.64307
398.7898 78.53693
399.2719 78.87314
399.7540 79.10896
400.2361 78.98927
400.7183 78.56763
401.2004 77.97672
401.6825 77.19159
402.1646 76.33717
402.6467 75.49002
403.1288 74.55341
403.6110 73.24016
404.0931 71.53459
404.5752 70.02448
405.0573 69.43285
405.5394 70.03970
406.0215 70.12804
406.5037 69.70705
406.9858 68.84109
407.4679 67.37981
407.9500 65.48976
408.4321 63.50691
408.9142 61.60464
409.3964 59.80446
409.8785 58.17838
410.3606 57.05356
410.8427 55.67430
411.3248 53.77046
411.8069 51.70145
412.2891 49.73921
412.7712 47.98112
413.2533 46.46301
413.7354 45.30261
414.2175 44.63693
414.6996 43.75404
415.1818 42.54460
415.6639 41.21631
416.1460 39.75734
416.6281 38.23424
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