#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:42:34 +0300 (Thu, 07 Jun 2018) $
#$Revision: 943 $
#$URL: svn://172.16.1.111/rod/cif/1/00/04/1000413.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_1000413
loop_
_publ_author_name
'Finch, R. J.'
'Burns, P. C.'
'Hawthorne, F. C.'
'Ewing, R. C.'
_publ_section_title
;
 Refinement of the crystal structure of billietite, Ba [(UO2)6 O4 (OH)6]
 (H2O)8 Locality: Shaba, Democratic Republic of Congo
;
_journal_name_full               'The Canadian Mineralogist'
_journal_page_first              1197
_journal_page_last               1205
_journal_paper_doi               10.2113/gscanmin.44.5.1197
_journal_volume                  44
_journal_year                    2006
_chemical_compound_source        R070588
_chemical_formula_sum            'Ba H6 O30 U6'
_chemical_name_mineral           Billietite
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2ab'
_symmetry_space_group_name_H-M   'P b n 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   12.0941
_cell_length_b                   30.211
_cell_length_c                   7.1563
_cell_volume                     2614.732
_exptl_crystal_density_diffrn    5.211
_cod_original_formula_sum        'Ba U6 O30 H6'
_cod_database_code               9010599
_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            R070588.rod
_rod_data_source.block           3500000
_rod_database.code               1000413
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 9010599 COD http://www.crystallography.net/cod/9010599.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
146.4769 0.0000000E+00
146.9590 4.296875
147.4411 24.12109
147.9232 166.1562
148.4053 292.0977
148.8875 385.0000
149.3696 443.4258
149.8517 479.2344
150.3338 469.9766
150.8159 446.1992
151.2980 442.7656
151.7802 497.2188
152.2623 540.3359
152.7444 546.5586
153.2265 488.1445
153.7086 450.3984
154.1908 457.5430
154.6729 491.1523
155.1550 510.9180
155.6371 519.1641
156.1192 504.5859
156.6013 459.5703
157.0834 326.3633
157.5656 225.2383
158.0477 191.7812
158.5298 218.1211
159.0119 258.2539
159.4940 335.1992
159.9761 402.4883
160.4583 420.6094
160.9404 316.7266
161.4225 213.6523
161.9046 168.1406
162.3867 186.0039
162.8688 215.1016
163.3510 220.9844
163.8331 223.2578
164.3152 251.3008
164.7973 353.0312
165.2794 461.3086
165.7615 527.2422
166.2437 535.3438
166.7258 528.9102
167.2079 525.5469
167.6900 526.6602
168.1721 536.5352
168.6542 555.9961
169.1364 585.2109
169.6185 627.8008
170.1006 698.4609
170.5827 762.2656
171.0648 790.8867
171.5469 786.4375
172.0291 761.0898
172.5112 696.1367
172.9933 620.6016
173.4754 579.3828
173.9575 623.4297
174.4396 688.9062
174.9218 694.8555
175.4039 640.5938
175.8860 577.7148
176.3681 546.7031
176.8502 542.1953
177.3323 549.2422
177.8144 576.6250
178.2966 652.0508
178.7787 699.9453
179.2608 722.3672
179.7429 747.8047
180.2250 769.8750
180.7071 768.9023
181.1893 797.1094
181.6714 924.9609
182.1535 1119.695
182.6356 1274.117
183.1177 1355.680
183.5998 1381.938
184.0820 1379.762
184.5641 1338.578
185.0462 1301.082
185.5283 1323.359
186.0104 1401.070
186.4925 1436.410
186.9747 1414.227
187.4568 1358.035
187.9389 1317.145
188.4210 1292.664
188.9031 1279.035
189.3852 1277.383
189.8674 1286.895
190.3495 1290.895
190.8316 1282.766
191.3137 1266.105
191.7958 1256.309
192.2779 1255.676
192.7601 1256.102
193.2422 1240.480
193.7243 1207.574
194.2064 1189.559
194.6885 1200.949
195.1706 1240.570
195.6528 1292.234
196.1349 1363.301
196.6170 1429.934
197.0991 1439.031
197.5812 1380.695
198.0633 1325.445
198.5455 1321.871
199.0276 1374.332
199.5097 1384.133
199.9918 1330.605
200.4739 1240.641
200.9560 1193.035
201.4381 1199.992
201.9203 1206.852
202.4024 1177.664
202.8845 1109.898
203.3666 1031.746
203.8487 946.0352
204.3308 858.1875
204.8130 771.2695
205.2951 686.1055
205.7772 604.2305
206.2593 527.1055
206.7414 456.4414
207.2235 387.6172
207.7057 324.9219
208.1878 267.4883
208.6699 176.9023
209.1520 25.83203
209.6341 118.2656
210.1162 172.8516
210.5984 108.5547
211.0805 45.40625
211.5626 18.00781
212.0447 30.89062
212.5268 45.79688
213.0089 70.83203
213.4911 91.29297
213.9732 76.47266
214.4553 6.218750
214.9374 50.24219
215.4195 64.39453
215.9016 24.61719
216.3838 18.49219
216.8659 70.68359
217.3480 123.8672
217.8301 160.3125
218.3122 179.6367
218.7943 183.7344
219.2765 170.0352
219.7586 127.2109
220.2407 96.85547
220.7228 86.90234
221.2049 89.38672
221.6870 73.83203
222.1691 31.41797
222.6513 16.59766
223.1334 61.21094
223.6155 115.9219
224.0976 135.6719
224.5797 93.66016
225.0618 4.972656
225.5440 10.17188
226.0261 91.69922
226.5082 213.3047
226.9903 276.5898
227.4724 246.2852
227.9545 229.0508
228.4367 244.4141
228.9188 291.8867
229.4009 324.7227
229.8830 326.1484
230.3651 327.8750
230.8472 363.8945
231.3294 457.4414
231.8115 541.3008
232.2936 604.9805
232.7757 649.5312
233.2578 660.0078
233.7399 610.7148
234.2221 548.6758
234.7042 533.6484
235.1863 595.7383
235.6684 655.9805
236.1505 689.8555
236.6326 688.0078
237.1148 707.9844
237.5969 762.7539
238.0790 832.4180
238.5611 885.8516
239.0432 915.6133
239.5253 941.0664
240.0075 969.5195
240.4896 1006.195
240.9717 1024.590
241.4538 1005.461
241.9359 973.3906
242.4180 984.5000
242.9002 1066.316
243.3823 1147.926
243.8644 1200.945
244.3465 1217.359
244.8286 1219.547
245.3107 1194.836
245.7928 1158.473
246.2750 1158.996
246.7571 1229.969
247.2392 1291.352
247.7213 1297.254
248.2034 1203.793
248.6855 1158.012
249.1677 1190.594
249.6498 1277.359
250.1319 1310.922
250.6140 1258.285
251.0961 1200.883
251.5782 1189.445
252.0604 1252.250
252.5425 1297.086
253.0246 1311.785
253.5067 1301.141
253.9888 1290.430
254.4709 1265.730
254.9531 1259.934
255.4352 1304.008
255.9173 1433.012
256.3994 1528.496
256.8815 1571.738
257.3636 1566.559
257.8458 1552.641
258.3279 1525.098
258.8100 1494.492
259.2921 1465.406
259.7742 1427.238
260.2563 1417.617
260.7385 1452.871
261.2206 1529.902
261.7027 1581.391
262.1848 1603.469
262.6669 1606.215
263.1490 1597.594
263.6312 1575.695
264.1133 1549.797
264.5954 1523.762
265.0775 1497.934
265.5596 1459.711
266.0417 1405.629
266.5239 1345.824
267.0060 1284.785
267.4881 1210.277
267.9702 1155.160
268.4523 1141.527
268.9344 1169.199
269.4166 1174.430
269.8987 1146.023
270.3808 1105.250
270.8629 1081.797
271.3450 1084.078
271.8271 1067.605
272.3093 1011.750
272.7914 914.1250
273.2735 850.7930
273.7556 829.9414
274.2377 822.1641
274.7198 783.7188
275.2020 707.3164
275.6841 645.5078
276.1662 624.7266
276.6483 645.9531
277.1304 644.0312
277.6125 612.8711
278.0946 577.9570
278.5768 584.9102
279.0589 639.8164
279.5410 675.0273
280.0231 656.3164
280.5052 587.3242
280.9873 535.1406
281.4695 500.1602
281.9516 478.1523
282.4337 466.8633
282.9158 464.2148
283.3979 458.8281
283.8800 439.3672
284.3622 407.1836
284.8443 417.6523
285.3264 483.4531
285.8085 555.2539
286.2906 544.9336
286.7727 455.1445
287.2549 383.1289
287.7370 398.4297
288.2191 479.5078
288.7012 499.1406
289.1833 443.6562
289.6654 362.1094
290.1476 318.8164
290.6297 312.0039
291.1118 318.2617
291.5939 337.1758
292.0760 361.4688
292.5581 361.4727
293.0403 330.6016
293.5224 294.4922
294.0045 285.8789
294.4866 301.8789
294.9687 325.7617
295.4508 362.2578
295.9330 399.2148
296.4151 397.6836
296.8972 345.8438
297.3793 295.7070
297.8614 332.7656
298.3435 431.8086
298.8257 501.1758
299.3078 458.0859
299.7899 361.9883
300.2720 313.0391
300.7541 322.1328
301.2362 358.9727
301.7184 411.3828
302.2005 469.1406
302.6826 507.2695
303.1647 496.3203
303.6468 464.2617
304.1289 444.8594
304.6111 441.8594
305.0932 447.6172
305.5753 465.6836
306.0574 488.8672
306.5395 499.7227
307.0216 478.7734
307.5038 448.7617
307.9859 429.2578
308.4680 421.9531
308.9501 428.2500
309.4322 464.3203
309.9143 514.7148
310.3965 548.1133
310.8786 541.9180
311.3607 519.5391
311.8428 486.6758
312.3249 435.3672
312.8070 417.1484
313.2892 493.3242
313.7713 616.0430
314.2534 707.1758
314.7355 703.9805
315.2176 682.4219
315.6997 680.7812
316.1819 704.4805
316.6640 739.9453
317.1461 796.6406
317.6282 858.7891
318.1103 904.2734
318.5924 901.3281
319.0746 901.3125
319.5567 938.3828
320.0388 1030.098
320.5209 1083.242
321.0030 1038.938
321.4851 953.3516
321.9673 897.5977
322.4494 901.4492
322.9315 923.2383
323.4136 951.6680
323.8957 985.8789
324.3778 1029.926
324.8599 1114.574
325.3420 1199.973
325.8242 1238.383
326.3063 1170.254
326.7884 1115.098
327.2705 1103.465
327.7526 1145.496
328.2347 1172.195
328.7169 1172.195
329.1990 1162.324
329.6811 1159.797
330.1632 1168.258
330.6453 1177.359
331.1274 1180.027
331.6096 1173.180
332.0917 1195.469
332.5738 1287.262
333.0559 1369.117
333.5380 1345.641
334.0201 1141.863
334.5023 997.2734
334.9844 979.6094
335.4665 1083.559
335.9486 1128.605
336.4307 1103.086
336.9128 1040.324
337.3950 961.7617
337.8771 859.8086
338.3592 782.8242
338.8413 745.5586
339.3234 743.0547
339.8055 745.4805
340.2877 759.4453
340.7698 777.7031
341.2519 795.8555
341.7340 815.4375
342.2161 808.4258
342.6982 752.3984
343.1804 672.8945
343.6625 666.7070
344.1446 743.9922
344.6267 820.9297
345.1088 811.7344
345.5909 733.5781
346.0731 704.0703
346.5552 768.4805
347.0373 863.7070
347.5194 863.9258
348.0015 774.4141
348.4836 680.9766
348.9658 666.0898
349.4479 693.1562
349.9300 658.8906
350.4121 519.0859
350.8942 368.5938
351.3763 346.4883
351.8585 427.5508
352.3406 500.3164
352.8227 486.5117
353.3048 427.2188
353.7869 375.1094
354.2690 336.9961
354.7512 312.9062
355.2333 313.0312
355.7154 328.4219
356.1975 336.9297
356.6796 318.4883
357.1617 293.4492
357.6439 277.0078
358.1260 270.5430
358.6081 274.8164
359.0902 311.4609
359.5723 356.5234
360.0544 369.8164
360.5366 306.3086
361.0187 230.8359
361.5008 170.2070
361.9829 124.6211
362.4650 106.7461
362.9471 158.4922
363.4293 228.5234
363.9114 253.6875
364.3935 160.3516
364.8756 78.13281
365.3577 53.93359
365.8398 100.7891
366.3220 130.8047
366.8041 110.9219
367.2862 81.19922
367.7683 79.82422
368.2504 150.8164
368.7325 197.5898
369.2146 191.0625
369.6967 129.4336
370.1789 107.9883
370.6610 148.3906
371.1431 206.1484
371.6252 251.5430
372.1073 297.2227
372.5894 298.4883
373.0716 228.4883
373.5537 104.7695
374.0358 46.08203
374.5179 79.75000
375.0000 122.5234
375.4821 114.9688
375.9643 48.81250
376.4464 10.44141
376.9285 57.81641
377.4106 91.17578
377.8927 100.6094
378.3748 82.41406
378.8570 62.09766
379.3391 58.15625
379.8212 68.14453
380.3033 65.15234
380.7854 43.35156
381.2675 18.33203
381.7497 27.46875
382.2318 65.91797
382.7139 82.49609
383.1960 30.33203
383.6781 59.64844
384.1602 114.5234
384.6424 126.9805
385.1245 124.3008
385.6066 134.6328
386.0887 152.7383
386.5708 164.6797
387.0529 155.4453
387.5351 142.6602
388.0172 155.4219
388.4993 195.6250
388.9814 215.2344
389.4635 149.7812
389.9456 52.55469
390.4278 5.218750
390.9099 24.45703
391.3920 78.99609
391.8741 134.3320
392.3562 188.8008
392.8383 232.3125
393.3205 269.8945
393.8026 289.7148
394.2847 281.9648
394.7668 208.8086
395.2489 147.4023
395.7310 133.2695
396.2132 150.7852
396.6953 131.8789
397.1774 11.00391
397.6595 104.4258
398.1416 162.2344
398.6237 113.4531
399.1059 79.58203
399.5880 80.06250
400.0701 91.86328
400.5522 59.62891
401.0343 62.92969
401.5164 161.5859
401.9986 182.0234
402.4807 92.14062
402.9628 67.03516
403.4449 128.8281
403.9270 228.6133
404.4091 307.2305
404.8913 370.4102
405.3734 379.3047
405.8555 294.5039
406.3376 130.0898
406.8197 54.98438
407.3018 83.11719
407.7840 142.5117
408.2661 160.2031
408.7482 140.8633
409.2303 131.3359
409.7124 153.3789
410.1945 186.8711
410.6767 180.0195
411.1588 135.7500
411.6409 94.20312
412.1230 92.51172
412.6051 115.1133
413.0872 127.2734
413.5693 113.7266
414.0515 103.9766
414.5336 124.2734
415.0157 171.9336
415.4978 239.7227
415.9799 354.8008
416.4620 469.3398
416.9442 536.6133
417.4263 538.5977
417.9084 533.5898
418.3905 562.9570
418.8726 602.6328
419.3547 615.4453
419.8369 530.3047
420.3190 467.2109
420.8011 497.7031
421.2832 641.4258
421.7653 735.6172
422.2474 701.9102
422.7296 628.9805
423.2117 595.5234
423.6938 658.7617
424.1759 706.6406
424.6580 714.5391
425.1401 689.1211
425.6223 695.9453
426.1044 748.8945
426.5865 819.5039
427.0686 894.0430
427.5507 976.8633
428.0328 1047.633
428.5150 1094.293
428.9971 1132.543
429.4792 1216.082
429.9613 1361.215
430.4434 1477.875
430.9255 1500.648
431.4077 1433.031
431.8898 1425.016
432.3719 1486.457
432.8540 1572.805
433.3361 1627.812
433.8182 1653.477
434.3004 1670.219
434.7825 1699.223
435.2646 1721.309
435.7467 1672.176
436.2288 1554.199
436.7109 1465.895
437.1931 1514.449
437.6752 1645.383
438.1573 1767.465
438.6394 1873.918
439.1215 1945.395
439.6036 1935.402
440.0858 1864.434
440.5679 1818.125
441.0500 1869.891
441.5321 1950.832
442.0142 2003.980
442.4963 2012.598
442.9785 2003.402
443.4606 1965.004
443.9427 1914.594
444.4248 1882.496
444.9069 1896.391
445.3890 1907.660
445.8712 1895.680
446.3533 1852.164
446.8354 1824.441
447.3175 1833.547
447.7996 1843.918
448.2817 1820.859
448.7639 1747.730
449.2460 1677.410
449.7281 1619.672
450.2102 1572.531
450.6923 1518.836
451.1744 1456.926
451.6566 1395.035
452.1387 1342.918
452.6208 1301.609
453.1029 1249.180
453.5850 1182.691
454.0671 1107.414
454.5493 1019.344
455.0314 920.6094
455.5135 848.1992
455.9956 846.5664
456.4777 890.1484
456.9598 913.1445
457.4420 911.1406
457.9240 884.8828
458.4062 826.1992
458.8883 748.7539
459.3704 672.2734
459.8525 588.9844
460.3346 522.2109
460.8167 497.5078
461.2989 509.4102
461.7810 523.8320
462.2631 532.5977
462.7452 533.2500
463.2273 524.0586
463.7094 503.1719
464.1916 475.7383
464.6737 432.5469
465.1558 384.1836
465.6379 353.4727
466.1200 355.1367
466.6021 362.8945
467.0843 367.2148
467.5664 363.9414
468.0485 374.3281
468.5306 412.0000
469.0127 449.1211
469.4948 454.5977
469.9770 418.6758
470.4591 375.5898
470.9412 324.9102
471.4233 272.5117
471.9054 254.6523
472.3875 279.0039
472.8697 299.5703
473.3518 280.0742
473.8339 226.4727
474.3160 171.8047
474.7981 116.6719
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1246.666 96.28516
1247.149 155.6523
1247.631 197.1641
1248.113 167.3848
1248.595 91.10352
1249.077 52.48828
1249.559 123.1035
1250.041 173.5000
1250.523 187.0840
1251.005 183.8008
1251.488 185.4141
1251.970 184.6855
1252.452 150.1562
1252.934 91.85938
1253.416 80.04492
1253.898 188.7480
1254.380 253.5859
1254.862 243.7734
1255.344 200.4277
1255.827 161.4883
1256.309 137.0801
1256.791 150.7207
1257.273 192.1934
1257.755 204.1172
1258.237 212.8203
1258.719 209.2227
1259.201 187.9590
1259.684 166.1719
1260.166 149.6016
1260.648 141.5273
1261.130 156.7832
1261.612 200.2090
1262.094 207.5234
1262.576 165.2695
1263.058 129.4805
1263.541 119.1426
1264.023 124.3730
1264.505 141.5879
1264.987 158.1465
1265.469 151.4277
1265.951 96.25195
1266.433 53.70703
1266.915 25.88086
1267.397 10.72070
1267.880 11.70312
1268.362 18.03711
1268.844 11.24805
1269.326 4.875000
1269.808 23.77539
1270.290 79.20508
1270.772 96.88867
1271.254 72.85156
1271.736 52.20508
1272.219 67.87109
1272.701 92.16602
1273.183 98.78320
1273.665 99.95312
1274.147 121.7051
1274.629 175.8672
1275.111 172.5957
1275.593 107.2305
1276.076 43.04492
1276.558 22.23438
1277.040 18.00977
1277.522 3.279297
1278.004 9.273438
1278.486 4.253906
1278.968 43.86523
1279.450 81.15039
1279.932 114.5215
1280.415 137.0059
1280.897 125.1055
1281.379 114.1562
1281.861 94.33984
1282.343 67.82031
1282.825 36.49023
1283.307 0.0000000E+00
