#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 13:43:14 +0300 (Thu, 26 Apr 2018) $
#$Revision: 528 $
#$URL: svn://172.16.1.111/rod/cif/1/00/00/1000080.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_1000080
loop_
_publ_author_name
'Pertlik, F.'
_publ_section_title
;
 The crystal structure of cechite, Pb(Fe,Mn)(VO4)(OH) with Fe>Mn. A
 mineral of the descloizite group Locality: Vrancice, Bohemian pluton,
 Pribram, Czechoslovakia (Czech Republic)
;
_journal_name_full               'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_page_first              34
_journal_page_last               40
_journal_volume                  1989
_journal_year                    1989
_chemical_compound_source        R070363
_chemical_formula_sum            'Fe0.8 H Mn0.2 O5 Pb V'
_chemical_name_mineral           Cechite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2n'
_symmetry_space_group_name_H-M   'P n a m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   7.605
_cell_length_b                   9.435
_cell_length_c                   6.099
_cell_volume                     437.623
_exptl_crystal_density_diffrn    5.992
_cod_original_formula_sum        'Pb (Fe.8 Mn.2) V O5 H'
_cod_database_code               9009356
_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            R070363.rod
_rod_data_source.block           3500000
_rod_database.code               1000080
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 9009356 COD http://www.crystallography.net/cod/9009356.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
93.84985 0.0000000E+00
94.33197 0.8173220
94.81409 2.504242
95.29620 3.061310
95.77832 2.648956
96.26044 1.337463
96.74255 0.2416990
97.22467 0.3232120
97.70679 2.172180
98.18890 4.332611
98.67102 6.251923
99.15314 7.407501
99.63525 7.521088
100.1174 6.493408
100.5995 4.682495
101.0816 3.464844
101.5637 3.499451
102.0458 4.565643
102.5280 5.276855
103.0101 5.977142
103.4922 6.744446
103.9743 7.464874
104.4564 8.561981
104.9385 9.578979
105.4207 10.53500
105.9028 11.25702
106.3849 12.13382
106.8670 12.95746
107.3491 12.65689
107.8312 9.997437
108.3134 5.165527
108.7955 1.436493
109.2776 0.3214720
109.7597 0.7102970
110.2418 0.6532590
110.7239 0.1903690
111.2061 0.5223390
111.6882 0.8161930
112.1703 0.8551940
112.6524 1.278564
113.1345 2.771606
113.6166 5.108246
114.0988 6.783539
114.5809 7.201538
115.0630 7.069595
115.5451 7.028442
116.0272 7.206985
116.5093 7.442505
116.9915 7.626602
117.4736 7.859787
117.9557 7.747482
118.4378 6.742905
118.9199 5.913712
119.4020 5.874924
119.8842 6.801788
120.3663 8.337036
120.8484 9.492157
121.3305 10.02992
121.8126 10.39893
122.2947 10.81284
122.7769 11.02100
123.2590 10.60934
123.7411 9.287521
124.2232 7.269852
124.7053 5.576889
125.1874 3.989166
125.6696 2.844177
126.1517 2.537384
126.6338 2.883133
127.1159 3.096222
127.5980 2.528870
128.0801 1.519363
128.5623 1.233841
129.0444 2.380554
129.5265 3.786469
130.0086 4.282593
130.4907 3.763870
130.9728 2.921936
131.4550 1.877792
131.9371 0.8305820
132.4192 0.1009520
132.9013 4.0359002E-02
133.3834 0.2045750
133.8655 0.1919100
134.3477 0.3511960
134.8298 0.7524870
135.3119 0.7022250
135.7940 0.3310240
136.2761 0.1454320
136.7582 0.5970310
137.2404 1.036331
137.7225 1.479767
138.2046 2.171494
138.6867 2.663345
139.1688 2.701782
139.6509 2.358368
140.1331 1.903824
140.6152 1.622757
141.0973 1.643555
141.5794 1.468445
142.0615 0.9223940
142.5436 0.3394930
143.0258 0.1290740
143.5079 0.4336550
143.9900 0.5676420
144.4721 0.5036930
144.9542 0.1277010
145.4363 0.2412260
145.9185 0.6233060
146.4006 0.9722900
146.8827 1.217514
147.3648 1.329361
147.8469 1.378586
148.3290 1.434509
148.8112 1.462173
149.2933 1.678528
149.7754 2.358459
150.2575 3.322495
150.7396 4.022903
151.2217 4.234680
151.7039 5.110962
152.1860 5.856705
152.6681 6.452347
153.1502 7.092316
153.6323 8.041672
154.1144 9.326004
154.5966 10.34183
155.0787 10.72466
155.5608 10.92177
156.0429 11.26630
156.5250 11.83189
157.0071 12.35242
157.4893 12.36267
157.9714 11.56548
158.4535 11.05846
158.9356 11.18645
159.4177 11.54126
159.8998 11.83368
160.3820 11.96230
160.8641 12.00891
161.3462 12.19099
161.8283 12.90144
162.3104 13.17358
162.7925 12.58893
163.2747 11.67366
163.7568 10.96404
164.2389 10.73561
164.7210 10.90182
165.2031 11.12030
165.6852 11.59216
166.1674 11.84990
166.6495 11.61317
167.1316 11.09341
167.6137 10.76514
168.0958 10.93692
168.5779 11.52814
169.0601 11.85271
169.5422 11.69142
170.0243 11.50435
170.5064 11.49820
170.9885 11.65083
171.4706 11.81134
171.9528 11.87608
172.4349 11.84540
172.9170 11.81087
173.3991 11.73715
173.8812 11.69388
174.3633 11.77573
174.8455 11.98558
175.3276 12.12401
175.8097 11.94336
176.2918 11.61652
176.7739 11.48112
177.2560 11.76892
177.7382 12.19165
178.2203 12.36845
178.7024 12.28813
179.1845 11.95612
179.6666 11.03654
180.1487 9.961670
180.6309 9.339279
181.1130 9.583405
181.5951 10.34184
182.0772 10.64178
182.5593 10.24223
183.0414 9.738480
183.5236 9.265106
184.0057 8.862473
184.4878 8.574066
184.9699 8.405579
185.4520 8.355164
185.9341 8.497955
186.4163 9.263153
186.8984 9.776566
187.3805 9.717255
187.8626 9.262497
188.3447 8.723511
188.8268 8.305649
189.3090 8.005661
189.7911 7.751785
190.2732 7.611511
190.7553 7.455338
191.2374 7.275330
191.7195 7.057404
192.2017 6.743637
192.6838 6.287186
193.1659 5.690582
193.6480 5.562988
194.1301 6.338974
194.6122 7.055740
195.0944 7.288788
195.5765 7.070068
196.0586 6.688477
196.5407 6.345413
197.0228 6.044312
197.5049 5.847519
197.9871 5.737335
198.4692 5.746445
198.9513 5.926041
199.4334 6.245224
199.9155 6.557251
200.3976 6.742188
200.8798 6.801636
201.3619 6.895218
201.8440 7.207764
202.3261 7.479523
202.8082 7.399017
203.2903 6.925354
203.7725 6.490128
204.2546 6.529999
204.7367 6.887955
205.2188 7.117249
205.7009 7.142349
206.1830 6.983780
206.6652 6.605133
207.1473 5.926239
207.6294 5.369705
208.1115 5.328278
208.5936 5.585251
209.0757 5.832703
209.5579 5.937073
210.0400 5.970139
210.5221 6.102219
211.0042 6.400345
211.4863 6.657074
211.9685 6.784843
212.4506 6.820404
212.9327 6.792221
213.4148 6.650635
213.8969 6.451691
214.3790 6.450035
214.8612 6.777832
215.3433 7.119171
215.8254 7.402702
216.3075 7.619858
216.7896 7.749710
217.2717 7.765648
217.7539 7.698166
218.2360 7.689316
218.7181 7.883484
219.2002 7.936325
219.6823 7.666664
220.1644 7.237396
220.6466 6.888496
221.1287 6.778915
221.6108 6.847755
222.0929 6.745872
222.5750 6.284576
223.0571 5.849640
223.5393 5.559990
224.0214 5.329559
224.5035 4.983337
224.9856 4.397888
225.4677 3.662560
225.9498 3.358322
226.4320 4.075333
226.9141 4.593094
227.3962 4.582054
227.8783 4.259949
228.3604 3.971298
228.8425 3.913528
229.3247 4.050690
229.8068 4.178932
230.2889 4.439117
230.7710 4.533424
231.2531 4.287491
231.7352 3.842400
232.2174 3.416351
232.6995 3.110909
233.1816 2.940735
233.6637 2.998466
234.1458 3.526665
234.6279 3.957741
235.1101 4.040825
235.5922 3.932671
236.0743 3.971672
236.5564 4.354965
237.0385 4.932327
237.5206 5.202713
238.0028 5.110207
238.4849 4.891129
238.9670 4.487907
239.4491 4.018822
239.9312 3.794212
240.4133 4.034760
240.8955 4.456551
241.3776 4.379791
241.8597 3.605347
242.3418 2.926643
242.8239 2.753632
243.3060 2.943710
243.7882 3.099464
244.2703 3.070084
244.7524 2.969383
245.2345 3.005882
245.7166 3.213821
246.1987 3.362183
246.6809 3.282875
247.1630 3.043854
247.6451 2.887466
248.1272 2.941124
248.6093 3.014771
249.0914 2.870087
249.5736 2.507027
250.0557 2.115845
250.5378 1.841934
251.0199 1.637985
251.5020 1.249168
251.9841 0.3824310
252.4663 0.3107760
252.9484 8.0269001E-02
253.4305 0.9550930
253.9126 1.768776
254.3947 1.595627
254.8768 0.6393360
255.3590 0.1594770
255.8411 0.7479860
256.3232 1.070930
256.8053 1.095779
257.2874 0.8639450
257.7695 0.5229720
258.2516 9.5992997E-02
258.7338 0.3883820
259.2159 0.7679210
259.6980 1.040558
260.1801 1.193268
260.6622 1.246613
261.1443 1.195084
261.6265 1.017448
262.1086 0.5954440
262.5907 3.0159000E-02
263.0728 0.1696400
263.5549 0.2833400
264.0370 0.6635210
264.5192 0.5964580
265.0013 0.2784420
265.4834 3.1792000E-02
265.9655 4.1625999E-02
266.4476 0.2454300
266.9297 0.4457400
267.4119 0.7741390
267.8940 0.8559950
268.3761 0.4566120
268.8582 0.1688540
269.3403 0.7402730
269.8224 1.139870
270.3046 1.355988
270.7867 1.326485
271.2688 0.8899460
271.7509 0.4856410
272.2330 0.2401350
272.7151 4.9690001E-02
273.1973 0.1940990
273.6794 0.5352550
274.1615 0.9275510
274.6436 1.281853
275.1257 1.602493
275.6078 1.866241
276.0900 1.899239
276.5721 1.981377
277.0542 2.450249
277.5363 3.373413
278.0184 4.383705
278.5005 4.798866
278.9827 4.191261
279.4648 3.947639
279.9469 4.356903
280.4290 4.930862
280.9111 5.316322
281.3932 5.468704
281.8754 5.619247
282.3575 6.093201
282.8396 7.036255
283.3217 7.881485
283.8038 8.766922
284.2859 9.468208
284.7681 9.720718
285.2502 9.601952
285.7323 9.484711
286.2144 9.795433
286.6965 10.66390
287.1786 11.21363
287.6608 11.08098
288.1429 11.00192
288.6250 11.38366
289.1071 12.09909
289.5892 12.72878
290.0714 12.91779
290.5535 12.65867
291.0356 12.49556
291.5177 12.61823
291.9998 12.64376
292.4819 12.33546
292.9641 11.85786
293.4462 11.53565
293.9283 11.59028
294.4104 11.95946
294.8925 12.20784
295.3746 12.29994
295.8568 12.29367
296.3389 12.19052
296.8210 11.99111
297.3031 11.68247
297.7852 11.25700
298.2673 10.74889
298.7495 10.25938
299.2316 9.690002
299.7137 9.261055
300.1958 8.979332
300.6779 8.839973
301.1600 8.901085
301.6422 9.165024
302.1243 9.472816
302.6064 9.520348
303.0885 9.015800
303.5706 8.771896
304.0527 9.006691
304.5349 9.332054
305.0170 9.406319
305.4991 9.198242
305.9812 8.974594
306.4633 9.076477
306.9454 9.628662
307.4276 10.07934
307.9097 10.54461
308.3918 10.83106
308.8739 10.68841
309.3560 10.21624
309.8381 9.785980
310.3203 9.703293
310.8024 9.997704
311.2845 10.53388
311.7666 11.52287
312.2487 12.49266
312.7308 13.31960
313.2130 13.99652
313.6951 14.51573
314.1772 14.88003
314.6593 15.12830
315.1414 15.43513
315.6235 15.80003
316.1057 16.23621
316.5878 16.92133
317.0699 17.62252
317.5520 17.92514
318.0341 17.62170
318.5162 17.04108
318.9984 17.07899
319.4805 18.38537
319.9626 19.59332
320.4447 20.69775
320.9268 21.60467
321.4089 22.22726
321.8911 22.58356
322.3732 22.83116
322.8553 23.18938
323.3374 23.76881
323.8195 24.16611
324.3016 24.11548
324.7838 24.09154
325.2659 24.48364
325.7480 25.25462
326.2301 26.03261
326.7122 26.45327
327.1943 26.46375
327.6765 26.43394
328.1586 26.31802
328.6407 26.24158
329.1228 26.34540
329.6049 26.51956
330.0870 26.50707
330.5692 26.11406
331.0513 25.43156
331.5334 25.11740
332.0155 25.94880
332.4976 26.27431
332.9797 25.34674
333.4619 23.93735
333.9440 23.18124
334.4261 23.58710
334.9082 24.50003
335.3904 24.29913
335.8725 21.83253
336.3546 20.03112
336.8367 19.33861
337.3188 19.07590
337.8009 18.75139
338.2831 18.23567
338.7652 17.64318
339.2473 17.15080
339.7294 16.85585
340.2115 16.33695
340.6936 15.18158
341.1758 14.19217
341.6579 13.91782
342.1400 14.21413
342.6221 14.49879
343.1042 14.23598
343.5863 13.42654
344.0685 12.94724
344.5506 13.17401
345.0327 13.37423
345.5148 13.38872
345.9969 13.27235
346.4790 13.13385
346.9612 13.03320
347.4433 12.94372
347.9254 12.76531
348.4075 12.40228
348.8896 12.11063
349.3717 11.97967
349.8539 11.89938
350.3360 11.78115
350.8181 11.59719
351.3002 11.35760
351.7823 11.04838
352.2644 10.60702
352.7466 10.30600
353.2287 10.34312
353.7108 10.37010
354.1929 10.22643
354.6750 9.900612
355.1571 9.449448
355.6393 8.888466
356.1214 8.216637
356.6035 7.611862
357.0856 7.007050
357.5677 6.573509
358.0498 6.503433
358.5320 6.616852
359.0141 6.614143
359.4962 6.333412
359.9783 5.836159
360.4604 5.228874
360.9425 4.341469
361.4247 3.747841
361.9068 3.958565
362.3889 4.335854
362.8710 4.242325
363.3531 3.492363
363.8352 2.579674
364.3174 2.112259
364.7995 2.136002
365.2816 2.129929
365.7637 1.998642
366.2458 1.815033
366.7279 1.590210
367.2101 1.341782
367.6922 1.148659
368.1743 1.113182
368.6564 1.191048
369.1385 1.165398
369.6206 0.9678420
370.1028 0.7836460
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371.0670 0.8659060
371.5491 0.8401720
372.0312 0.5699390
372.5133 0.2283940
372.9955 9.2093997E-02
373.4776 0.1884460
373.9597 0.2223130
374.4418 2.5443999E-02
374.9239 0.3453980
375.4060 0.4224780
375.8882 0.1541210
376.3703 2.6077000E-02
376.8524 0.3880230
377.3345 1.196068
377.8166 1.503494
378.2987 0.9237210
378.7809 0.1301880
379.2630 0.1158070
379.7451 0.1155550
380.2272 0.3811570
380.7093 0.6112060
381.1914 0.7614900
381.6736 0.7408680
382.1557 0.5372470
382.6378 0.2921450
383.1199 6.5567002E-02
383.6020 0.1154790
384.0841 0.1755680
384.5663 4.2946000E-02
385.0484 0.1405330
385.5305 0.3654400
386.0126 0.5870360
386.4947 0.6491320
386.9768 0.4647220
387.4590 0.1334000
387.9411 0.1569210
388.4232 0.4346540
388.9053 0.6090090
389.3874 0.5918200
389.8695 0.4950790
390.3517 0.4004900
390.8338 0.3317570
391.3159 0.3983080
391.7980 0.7723920
392.2801 1.523727
392.7622 1.871811
393.2444 1.367645
393.7265 0.9229890
394.2086 1.014595
394.6907 1.552124
395.1728 2.285248
395.6549 3.102341
396.1371 3.911964
396.6192 4.319519
397.1013 3.753036
397.5834 3.489204
398.0655 3.787773
398.5476 4.346184
399.0298 4.942139
399.5119 5.484642
399.9940 5.870949
400.4761 5.892494
400.9582 5.280472
401.4403 5.272057
401.9225 6.391769
402.4046 7.536507
402.8867 8.180611
403.3688 8.418800
403.8509 8.616989
404.3330 9.028870
404.8152 9.608994
405.2973 10.09378
405.7794 10.39654
406.2615 10.73247
406.7436 11.19047
407.2257 11.67368
407.7079 12.08507
408.1900 12.39612
408.6721 12.63972
409.1542 12.78738
409.6363 12.76538
410.1184 13.07452
410.6006 14.09990
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