#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:42:53 +0300 (Thu, 07 Jun 2018) $
#$Revision: 948 $
#$URL: svn://172.16.1.111/rod/cif/1/00/04/1000416.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_1000416
loop_
_publ_author_name
'Shannon, R. D.'
'Calvo, C.'
_publ_section_title
;
 Refinement of the crystal structure of synthetic chervetite, Pb2V2O7
;
_journal_name_full               'Canadian Journal of Chemistry'
_journal_page_first              70
_journal_page_last               76
_journal_paper_doi               10.1139/v73-010
_journal_volume                  51
_journal_year                    1973
_chemical_compound_source        Synthetic
_chemical_formula_sum            'O7 Pb2 V2'
_chemical_name_mineral           Chervetite
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yab'
_symmetry_space_group_name_H-M   'P 1 21/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 105.935
_cell_angle_gamma                90
_cell_length_a                   13.3689
_cell_length_b                   7.1607
_cell_length_c                   7.1027
_cell_volume                     653.819
_exptl_crystal_density_diffrn    6.383
_cod_original_formula_sum        'Pb2 V2 O7'
_cod_database_code               9014475
_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            R080096.rod
_rod_data_source.block           3500000
_rod_database.code               1000416
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 9014475 COD http://www.crystallography.net/cod/9014475.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
149.2433 0.0000000E+00
149.7254 24.25269
150.2075 33.46326
150.6896 45.22620
151.1718 40.15527
151.6539 18.98022
152.1360 37.11804
152.6181 31.40015
153.1002 36.07727
153.5823 39.88257
154.0645 21.22461
154.5466 6.2259999E-03
155.0287 10.55286
155.5108 2.873535
155.9929 12.05042
156.4750 9.621826
156.9572 1.502319
157.4393 9.565063
157.9214 13.20422
158.4035 12.46191
158.8856 7.393555
159.3677 2.665283
159.8499 16.35364
160.3320 35.03357
160.8141 57.78467
161.2962 79.28577
161.7783 95.29980
162.2604 110.1456
162.7426 127.3806
163.2247 152.0396
163.7068 175.8217
164.1889 194.7079
164.6710 208.7339
165.1531 221.7662
165.6353 234.6960
166.1174 247.8864
166.5995 261.7288
167.0816 277.5400
167.5637 293.1371
168.0458 307.4072
168.5280 320.1754
169.0101 331.5571
169.4922 337.0616
169.9743 341.9171
170.4564 353.4221
170.9385 376.4484
171.4207 406.1990
171.9028 439.3223
172.3849 475.5912
172.8670 513.9299
173.3491 555.9337
173.8312 599.6207
174.3134 641.3679
174.7955 680.8281
175.2776 716.5259
175.7597 740.6787
176.2418 750.6523
176.7239 769.7324
177.2061 836.1680
177.6882 932.3774
178.1703 1009.290
178.6524 1036.325
179.1345 1031.475
179.6166 1022.355
180.0988 1009.934
180.5809 996.0383
181.0630 984.9497
181.5451 974.9042
182.0272 959.2595
182.5093 931.4330
182.9915 895.3818
183.4736 863.2413
183.9557 837.5526
184.4378 808.4543
184.9199 754.5962
185.4020 680.8325
185.8842 614.4225
186.3663 575.3503
186.8484 557.0040
187.3305 537.0883
187.8126 513.2972
188.2947 488.7065
188.7769 467.5469
189.2590 449.7654
189.7411 434.6116
190.2232 419.6165
190.7053 405.9346
191.1874 401.9701
191.6696 410.7222
192.1517 424.8807
192.6338 432.1414
193.1159 432.4579
193.5980 427.2247
194.0801 413.2224
194.5623 391.5959
195.0444 378.8352
195.5265 378.2285
196.0086 384.7234
196.4907 388.7239
196.9728 390.2408
197.4550 389.1169
197.9371 384.5842
198.4192 376.5919
198.9013 368.3442
199.3834 359.9818
199.8655 351.6948
200.3477 341.8059
200.8298 328.6450
201.3119 321.7979
201.7940 329.6489
202.2761 353.7969
202.7582 374.1602
203.2404 387.5634
203.7225 397.1952
204.2046 411.9543
204.6867 432.5964
205.1688 455.8933
205.6509 479.3215
206.1331 502.5020
206.6152 528.9110
207.0973 557.8904
207.5794 590.1724
208.0615 626.5293
208.5436 668.5331
209.0258 710.6167
209.5079 748.2214
209.9900 779.6101
210.4721 813.9126
210.9542 852.7719
211.4363 894.7151
211.9185 934.1467
212.4006 967.6930
212.8827 1004.929
213.3648 1052.846
213.8469 1113.301
214.3290 1174.462
214.8112 1234.753
215.2933 1294.842
215.7754 1360.744
216.2575 1435.333
216.7396 1510.978
217.2217 1582.516
217.7038 1648.426
218.1860 1713.961
218.6681 1779.251
219.1502 1844.056
219.6323 1907.838
220.1144 1973.541
220.5965 2032.329
221.0787 2078.157
221.5608 2107.060
222.0429 2134.677
222.5250 2160.026
223.0071 2184.570
223.4892 2215.908
223.9714 2265.448
224.4535 2303.767
224.9356 2312.682
225.4177 2277.516
225.8998 2248.813
226.3819 2230.155
226.8641 2219.818
227.3462 2211.422
227.8283 2202.464
228.3104 2198.201
228.7925 2199.730
229.2746 2201.162
229.7568 2220.111
230.2389 2261.715
230.7210 2322.586
231.2031 2389.096
231.6852 2465.414
232.1673 2537.477
232.6495 2599.370
233.1316 2651.078
233.6137 2695.275
234.0958 2728.409
234.5779 2753.045
235.0600 2778.039
235.5422 2808.496
236.0243 2832.714
236.5064 2845.619
236.9885 2844.423
237.4706 2838.360
237.9527 2829.356
238.4349 2815.076
238.9170 2787.426
239.3991 2733.170
239.8812 2685.339
240.3633 2660.325
240.8454 2672.915
241.3276 2670.145
241.8097 2639.719
242.2918 2598.575
242.7739 2585.402
243.2560 2613.351
243.7381 2648.965
244.2203 2679.667
244.7024 2702.122
245.1845 2728.611
245.6666 2756.801
246.1487 2790.099
246.6308 2836.257
247.1130 2899.641
247.5951 2969.104
248.0772 3041.150
248.5593 3117.585
249.0414 3190.511
249.5235 3255.269
250.0057 3319.304
250.4878 3397.944
250.9699 3501.858
251.4520 3601.627
251.9341 3686.042
252.4162 3752.255
252.8984 3819.858
253.3805 3892.120
253.8626 3963.741
254.3447 4027.040
254.8268 4088.448
255.3089 4130.678
255.7911 4148.914
256.2732 4143.106
256.7553 4115.455
257.2374 4064.584
257.7195 3992.867
258.2017 3904.063
258.6838 3799.604
259.1659 3672.421
259.6480 3513.449
260.1301 3322.610
260.6122 3141.660
261.0944 2975.398
261.5765 2812.168
262.0586 2637.188
262.5407 2445.038
263.0228 2257.221
263.5049 2078.965
263.9871 1908.837
264.4692 1749.729
264.9513 1597.997
265.4334 1460.788
265.9155 1346.732
266.3976 1267.632
266.8798 1177.758
267.3619 1064.474
267.8440 931.6899
268.3261 820.1763
268.8082 733.9312
269.2903 660.8455
269.7725 593.2438
270.2546 532.5061
270.7367 474.7212
271.2188 419.5427
271.7009 367.4998
272.1830 319.3138
272.6652 275.0198
273.1473 235.5226
273.6294 201.4741
274.1115 173.4291
274.5936 148.1326
275.0757 125.4569
275.5579 104.8799
276.0400 86.01318
276.5221 69.19604
277.0042 52.68481
277.4863 34.91577
277.9684 15.63049
278.4506 1.455078
278.9327 16.18982
279.4148 28.49927
279.8969 38.06848
280.3790 44.79749
280.8611 49.48535
281.3433 51.48474
281.8254 50.84705
282.3075 52.24817
282.7896 55.82812
283.2717 61.48315
283.7538 70.56909
284.2360 83.31616
284.7181 93.55945
285.2002 99.43201
285.6823 100.8075
286.1644 94.10071
286.6465 77.25012
287.1287 59.95715
287.6108 58.33069
288.0929 71.28076
288.5750 78.34143
289.0571 67.45227
289.5392 44.45703
290.0214 34.56091
290.5035 39.08838
290.9856 45.83826
291.4677 42.56738
291.9498 30.22180
292.4319 14.91821
292.9141 1.532837
293.3962 19.82263
293.8783 41.98389
294.3604 67.97668
294.8425 96.01025
295.3246 124.4075
295.8068 153.8450
296.2889 185.7289
296.7710 220.0950
297.2531 257.9530
297.7352 300.2654
298.2173 346.8734
298.6995 398.4731
299.1816 449.9835
299.6637 507.0811
300.1458 581.4469
300.6279 678.0598
301.1100 787.5874
301.5922 897.7051
302.0743 1009.759
302.5564 1128.752
303.0385 1259.377
303.5206 1398.661
304.0027 1547.473
304.4849 1706.717
304.9670 1866.207
305.4491 2014.069
305.9312 2152.976
306.4133 2289.386
306.8954 2427.388
307.3776 2564.322
307.8597 2695.313
308.3418 2821.179
308.8239 2942.728
309.3060 3049.387
309.7881 3155.137
310.2703 3278.464
310.7524 3436.964
311.2345 3609.880
311.7166 3779.581
312.1987 3946.238
312.6808 4122.140
313.1630 4317.716
313.6451 4526.535
314.1272 4743.338
314.6093 4957.644
315.0914 5184.724
315.5735 5421.242
316.0557 5671.093
316.5378 5955.253
317.0199 6293.056
317.5020 6660.944
317.9841 7050.350
318.4662 7474.105
318.9484 7884.796
319.4305 8280.746
319.9126 8653.037
320.3947 8978.142
320.8768 9336.949
321.3589 9580.712
321.8411 9636.145
322.3232 9479.476
322.8053 9167.929
323.2874 8659.660
323.7695 8012.589
324.2516 7318.391
324.7338 6495.249
325.2159 5715.190
325.6980 5027.027
326.1801 4434.167
326.6622 3920.383
327.1443 3486.068
327.6265 3125.207
328.1086 2831.464
328.5907 2637.313
329.0728 2476.407
329.5549 2340.416
330.0370 2228.926
330.5192 2148.106
331.0013 2118.172
331.4834 2101.119
331.9655 2070.938
332.4476 2023.208
332.9297 1968.705
333.4119 1901.153
333.8940 1826.829
334.3761 1775.231
334.8582 1753.421
335.3403 1744.651
335.8224 1740.037
336.3046 1735.458
336.7867 1745.736
337.2688 1774.652
337.7509 1816.155
338.2330 1857.207
338.7151 1894.107
339.1973 1941.982
339.6794 2007.916
340.1615 2091.558
340.6436 2186.304
341.1257 2293.408
341.6078 2406.148
342.0899 2511.678
342.5721 2606.398
343.0542 2720.908
343.5363 2868.083
344.0184 3041.199
344.5005 3212.946
344.9826 3380.824
345.4648 3554.622
345.9469 3741.890
346.4290 3944.069
346.9111 4153.001
347.3932 4377.781
347.8753 4597.101
348.3575 4764.518
348.8396 4881.329
349.3217 4972.713
349.8038 5064.462
350.2859 5142.104
350.7680 5162.574
351.2502 5112.030
351.7323 5034.833
352.2144 4967.233
352.6965 4912.199
353.1786 4880.878
353.6607 4883.011
354.1429 4909.746
354.6250 4953.861
355.1071 5015.475
355.5892 5085.140
356.0713 5168.900
356.5534 5253.101
357.0356 5317.638
357.5177 5356.436
357.9998 5371.885
358.4819 5355.833
358.9640 5313.132
359.4461 5270.892
359.9283 5238.085
360.4104 5213.836
360.8925 5195.508
361.3746 5170.604
361.8567 5173.421
362.3388 5231.811
362.8210 5327.502
363.3031 5421.139
363.7852 5489.189
364.2673 5561.114
364.7494 5655.088
365.2315 5782.402
365.7137 5897.903
366.1958 6001.684
366.6779 6085.309
367.1600 6139.200
367.6421 6164.694
368.1242 6156.882
368.6064 6106.312
369.0885 6010.981
369.5706 5916.499
370.0527 5830.997
370.5348 5739.260
371.0169 5632.595
371.4991 5531.947
371.9812 5383.402
372.4633 5179.864
372.9454 4924.992
373.4275 4633.034
373.9096 4283.008
374.3918 3927.156
374.8739 3590.528
375.3560 3264.726
375.8381 2975.049
376.3202 2726.576
376.8023 2513.108
377.2845 2328.557
377.7666 2176.230
378.2487 2039.419
378.7308 1916.141
379.2129 1805.390
379.6950 1712.525
380.1772 1637.682
380.6593 1575.455
381.1414 1523.661
381.6235 1482.101
382.1056 1439.843
382.5877 1393.952
383.0699 1345.733
383.5520 1298.193
384.0341 1251.427
384.5162 1206.098
384.9983 1162.464
385.4804 1119.272
385.9626 1074.569
386.4447 1028.598
386.9268 979.9377
387.4089 925.6707
387.8910 867.3350
388.3731 809.5408
388.8553 750.6425
389.3374 694.8486
389.8195 649.7047
390.3016 615.4213
390.7837 579.3987
391.2658 529.5035
391.7480 475.5338
392.2301 427.9625
392.7122 391.8341
393.1943 359.8374
393.6764 328.8722
394.1585 299.4993
394.6407 274.0020
395.1228 252.9185
395.6049 235.9484
396.0870 224.0379
396.5691 220.2205
397.0512 212.2295
397.5334 194.0652
398.0155 171.6681
398.4976 152.5887
398.9797 140.9115
399.4618 128.7275
399.9439 113.5887
400.4261 95.59595
400.9082 80.77380
401.3903 67.85522
401.8724 59.13696
402.3545 56.92059
402.8366 66.06067
403.3188 71.21375
403.8009 70.87592
404.2830 66.36053
404.7651 60.46545
405.2472 52.56232
405.7293 45.26489
406.2115 39.70544
406.6936 36.01160
407.1757 33.00708
407.6578 31.18073
408.1399 28.95813
408.6220 23.75024
409.1042 15.75409
409.5863 7.969910
410.0684 0.4627690
410.5505 5.684021
411.0326 6.952881
411.5147 3.549622
411.9969 1.134216
412.4790 5.598328
412.9611 13.99872
413.4432 19.40735
413.9253 21.02252
414.4074 19.40857
414.8896 11.84790
415.3717 1.369019
415.8538 4.816711
416.3359 1.330322
416.8180 10.38422
417.3001 12.53210
417.7823 7.914429
418.2644 4.997864
418.7465 11.69922
419.2286 21.17151
419.7107 26.65247
420.1928 24.72278
420.6750 20.91083
421.1571 16.00134
421.6392 10.68427
422.1213 6.825012
422.6034 4.827148
423.0855 4.471680
423.5677 6.580811
424.0498 12.82153
424.5319 15.56152
425.0140 11.02185
425.4961 4.236450
425.9782 0.3399660
426.4604 2.110535
426.9425 2.604309
427.4246 3.6804002E-02
427.9067 5.087158
428.3888 7.338318
428.8709 5.798035
429.3531 3.257080
429.8352 1.523376
430.3173 1.246460
430.7994 2.101318
431.2815 10.20865
431.7636 18.93863
432.2458 19.97186
432.7279 12.73544
433.2100 7.753021
433.6921 10.67700
434.1742 18.41104
434.6563 18.65344
435.1385 11.25671
435.6206 2.589722
436.1027 2.063690
436.5848 3.744598
437.0669 5.703125
437.5490 9.396118
438.0312 11.37698
438.5133 4.656311
438.9954 7.369080
439.4775 15.34216
439.9596 9.918060
440.4417 1.141602
440.9239 0.5726930
441.4060 5.379333
441.8881 8.974152
442.3702 2.820251
442.8523 7.677002
443.3344 17.49884
443.8166 28.44092
444.2987 34.96988
444.7808 31.88263
445.2629 22.60004
445.7450 17.10327
446.2271 23.57050
446.7093 29.05081
447.1914 27.47690
447.6735 14.85776
448.1556 7.705963
448.6377 9.018036
449.1198 13.87033
449.6020 17.46967
450.0841 18.97311
450.5662 20.79904
451.0483 23.90671
451.5304 27.77859
452.0125 29.26111
452.4947 26.96265
452.9768 25.78198
453.4589 30.48865
453.9410 41.56750
454.4231 45.43512
454.9052 40.27908
455.3874 32.92560
455.8695 33.79132
456.3516 41.53870
456.8337 45.93488
457.3158 41.36533
457.7979 33.66995
458.2801 34.08722
458.7622 41.47299
459.2443 48.46198
459.7264 50.30371
460.2085 49.43582
460.6906 48.37473
461.1728 46.95694
461.6549 45.70825
462.1370 45.76266
462.6191 46.86517
463.1012 48.53201
463.5833 52.00854
464.0655 53.79816
464.5476 49.82764
465.0297 41.51126
465.5118 39.08569
465.9939 52.07056
466.4760 66.97318
466.9582 76.69116
467.4403 77.56052
467.9224 77.92166
468.4045 76.41373
468.8866 74.51028
469.3687 75.12222
469.8509 80.94473
470.3330 85.48608
470.8151 86.86578
471.2972 84.88461
471.7793 81.95477
472.2614 77.82562
472.7436 74.94662
473.2257 75.94870
473.7078 80.80356
474.1899 81.66562
474.6720 76.61371
475.1541 69.55841
475.6363 66.20731
476.1184 66.37250
476.6005 68.74673
477.0826 75.85770
477.5647 83.30725
478.0468 81.57700
478.5290 71.39447
479.0111 61.81628
479.4932 60.17108
479.9753 62.88297
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1245.094 25.22076
1245.577 15.33142
1246.059 13.02234
1246.541 18.61496
1247.023 22.23282
1247.505 22.71384
1247.987 21.67154
1248.469 19.06400
1248.951 16.37720
1249.433 16.02689
1249.916 16.36929
1250.398 14.93362
1250.880 11.79706
1251.362 10.98459
1251.844 13.10693
1252.326 15.44263
1252.808 17.58194
1253.290 18.88062
1253.773 17.97641
1254.255 16.77142
1254.737 17.55701
1255.219 20.22839
1255.701 22.42908
1256.183 24.39923
1256.665 22.93750
1257.147 16.46036
1257.630 11.34119
1258.112 16.70822
1258.594 23.32077
1259.076 22.60944
1259.558 16.09341
1260.040 9.776154
1260.522 3.760315
1261.004 1.505890
1261.486 4.077698
1261.969 8.394196
1262.451 14.43564
1262.933 19.13330
1263.415 20.54077
1263.897 19.08011
1264.379 13.53418
1264.861 5.259796
1265.343 7.018036
1265.825 23.38586
1266.308 34.54947
1266.790 21.89560
1267.272 8.814636
1267.754 7.057373
1268.236 12.56650
1268.718 16.29132
1269.200 18.08926
1269.682 16.18503
1270.165 9.526764
1270.647 6.543854
1271.129 18.00024
1271.611 23.93500
1272.093 15.53751
1272.575 1.238708
1273.057 2.116364
1273.539 1.720428
1274.021 4.908875
1274.504 6.154694
1274.986 6.143616
1275.468 4.214172
1275.950 2.844482
1276.432 2.605225
1276.914 3.291443
1277.396 3.312073
1277.878 7.167969
1278.360 7.520996
1278.843 2.459900
1279.325 0.5831600
1279.807 3.903015
1280.289 4.306396
1280.771 0.0000000E+00
