#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-04-26 13:43:35 +0300 (Thu, 26 Apr 2018) $ #$Revision: 533 $ #$URL: svn://172.16.1.111/rod/cif/1/00/00/1000085.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_1000085 loop_ _publ_author_name 'Yakubovich, O. V.' 'Massa, W.' 'Chukanov, N. V.' _publ_section_title ; Crystal structure of britvinite [Pb7(OH)3F(BO3)2(CO3)][Mg4.5(OH)3(Si5O14)]: A new layered silicate with an original type of silicon-oxygen networks Locality: Varmland, Sweden ; _journal_name_full 'Crystallography Reports' _journal_page_first 206 _journal_page_last 215 _journal_paper_doi 10.1134/S1063774508020077 _journal_volume 53 _journal_year 2008 _chemical_compound_source R070639 _chemical_formula_sum 'C2 B3.468 F2 Mg9 O58 Pb14.144 Si10.532' _chemical_name_mineral Britvinite _space_group_IT_number 2 _symmetry_space_group_name_Hall '-P 1' _symmetry_space_group_name_H-M 'P -1' _cell_angle_alpha 80.365 _cell_angle_beta 75.816 _cell_angle_gamma 59.870 _cell_length_a 9.3409 _cell_length_b 9.3579 _cell_length_c 18.8333 _cell_volume 1378.475 _exptl_crystal_density_diffrn 5.388 _cod_original_formula_sum 'Si10.532 Mg9 Pb14.144 C2 B3.468 O58 F2' _cod_database_code 9012668 _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 R070639.rod _rod_data_source.block 3500000 _rod_database.code 1000085 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 9012668 COD http://www.crystallography.net/cod/9012668.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 154.7179 0.0000000E+00 155.2001 91.79688 155.6822 122.2803 156.1643 67.97949 156.6464 43.85352 157.1285 96.41211 157.6106 158.6387 158.0928 209.9756 158.5749 198.8359 159.0570 156.7812 159.5391 106.5469 160.0212 41.22266 160.5033 0.9707030 160.9855 10.73633 161.4676 4.909180 161.9497 25.98828 162.4318 73.73145 162.9139 114.9668 163.3960 129.8184 163.8782 116.7471 164.3603 119.9180 164.8424 156.1426 165.3245 192.2549 165.8066 205.4824 166.2887 196.9551 166.7709 189.9951 167.2530 196.7051 167.7351 210.0176 168.2172 219.5254 168.6993 232.6611 169.1814 243.2129 169.6636 246.1465 170.1457 242.9219 170.6278 241.9902 171.1099 240.1025 171.5920 233.3594 172.0741 227.0869 172.5563 230.4619 173.0384 230.3711 173.5205 223.2754 174.0026 212.5918 174.4847 204.1104 174.9668 195.9951 175.4490 187.5625 175.9311 180.7207 176.4132 180.4258 176.8953 184.2236 177.3774 173.0635 177.8595 130.9668 178.3417 85.69238 178.8238 55.84668 179.3059 43.02441 179.7880 38.62500 180.2701 45.50977 180.7522 75.62109 181.2344 104.9248 181.7165 97.47559 182.1986 93.37695 182.6807 110.5020 183.1628 147.0625 183.6449 185.2173 184.1271 205.2598 184.6092 224.4849 185.0913 227.0430 185.5734 199.6567 186.0555 166.6416 186.5376 145.0752 187.0198 141.6523 187.5019 152.0806 187.9840 162.5732 188.4661 184.6445 188.9482 191.9541 189.4303 161.1567 189.9125 120.3071 190.3946 104.2300 190.8767 131.1870 191.3588 191.1772 191.8409 235.0156 192.3230 258.6797 192.8052 272.3315 193.2873 263.9053 193.7694 246.0391 194.2515 242.9771 194.7336 271.2358 195.2157 326.3535 195.6979 364.9951 196.1800 387.6191 196.6621 398.4429 197.1442 387.8618 197.6263 364.3101 198.1084 351.9521 198.5906 370.6343 199.0727 418.0117 199.5548 444.9463 200.0369 445.7681 200.5190 432.7178 201.0011 413.3169 201.4833 387.5088 201.9654 349.2920 202.4475 285.5815 202.9296 202.2290 203.4117 146.0596 203.8938 139.2964 204.3760 147.1719 204.8581 141.3159 205.3402 119.8350 205.8223 89.22168 206.3044 46.20459 206.7865 3.512695 207.2687 37.86230 207.7508 39.68311 208.2329 28.68506 208.7150 32.24902 209.1971 54.45264 209.6792 80.60645 210.1614 102.1558 210.6435 119.0933 211.1256 129.5239 211.6077 129.5181 212.0898 122.9463 212.5719 79.73242 213.0541 39.33398 213.5362 2.770996 214.0183 25.80078 214.5004 49.69531 214.9825 78.01562 215.4646 124.6392 215.9468 181.7734 216.4289 214.2563 216.9110 203.9146 217.3931 192.7412 217.8752 207.2168 218.3573 240.2017 218.8395 271.4268 219.3216 288.4224 219.8037 292.4565 220.2858 293.5435 220.7679 293.0288 221.2500 287.0557 221.7322 269.2964 222.2143 243.7271 222.6964 221.8784 223.1785 214.7749 223.6606 223.1572 224.1427 227.7295 224.6249 222.3950 225.1070 218.5596 225.5891 222.1841 226.0712 231.9043 226.5533 241.8491 227.0354 244.7612 227.5176 238.4038 227.9997 241.0752 228.4818 270.6284 228.9639 294.3135 229.4460 293.6191 229.9281 272.1675 230.4103 248.2695 230.8924 240.6265 231.3745 251.8403 231.8566 267.9043 232.3387 301.2588 232.8208 328.8242 233.3030 336.9707 233.7851 327.0566 234.2672 310.7622 234.7493 299.1016 235.2314 289.2832 235.7135 295.1587 236.1957 330.5962 236.6778 367.3647 237.1599 391.1006 237.6420 400.7729 238.1241 403.6646 238.6062 408.0703 239.0884 415.1030 239.5705 417.9189 240.0526 403.9219 240.5347 395.8213 241.0168 413.9634 241.4989 456.8848 241.9811 502.4102 242.4632 524.1987 242.9453 511.2417 243.4274 506.1343 243.9095 507.7266 244.3916 516.4180 244.8738 537.2681 245.3559 568.9399 245.8380 600.7427 246.3201 620.1006 246.8022 622.0566 247.2843 624.4287 247.7665 622.9507 248.2486 624.5278 248.7307 636.2744 249.2128 658.5908 249.6949 685.1040 250.1770 709.7095 250.6592 733.4771 251.1413 748.3364 251.6234 742.4058 252.1055 736.0762 252.5876 749.3569 253.0697 783.2480 253.5519 817.9043 254.0340 830.0859 254.5161 811.5098 254.9982 801.2773 255.4803 807.3604 255.9624 816.3525 256.4445 815.7983 256.9267 804.8345 257.4088 794.6533 257.8909 797.7520 258.3730 818.1338 258.8551 832.5020 259.3372 844.5449 259.8194 848.1240 260.3015 835.5347 260.7836 806.3018 261.2657 769.7686 261.7478 733.2148 262.2299 696.4897 262.7121 668.3960 263.1942 650.7817 263.6763 640.3823 264.1584 636.8208 264.6405 638.3667 265.1227 638.5508 265.6048 632.4976 266.0869 620.5596 266.5690 615.7090 267.0511 622.9043 267.5332 631.9380 268.0154 639.6104 268.4975 645.0244 268.9796 637.4854 269.4617 602.3477 269.9438 540.6069 270.4259 502.1958 270.9081 498.3350 271.3902 510.5654 271.8723 529.4546 272.3544 552.8057 272.8365 569.4521 273.3186 569.7729 273.8008 554.0986 274.2829 539.4570 274.7650 523.6577 275.2471 510.1670 275.7292 501.1685 276.2113 497.0229 276.6935 498.3931 277.1756 507.2402 277.6577 522.7036 278.1398 536.0112 278.6219 547.9912 279.1040 557.2207 279.5862 564.7881 280.0683 569.9536 280.5504 565.3569 281.0325 540.0059 281.5146 502.8853 281.9967 488.2358 282.4789 506.2793 282.9610 536.5122 283.4431 570.8286 283.9252 608.4009 284.4073 643.6494 284.8894 674.7422 285.3716 700.2397 285.8537 718.0278 286.3358 719.7168 286.8179 724.6914 287.3000 744.9614 287.7821 777.9487 288.2643 814.1123 288.7464 851.7573 289.2285 887.9604 289.7106 915.8525 290.1927 932.5083 290.6748 947.2905 291.1570 960.9419 291.6391 975.4482 292.1212 995.7153 292.6033 1021.358 293.0854 1057.550 293.5675 1121.910 294.0497 1237.506 294.5318 1320.457 295.0139 1299.789 295.4960 1222.263 295.9781 1203.515 296.4602 1294.833 296.9424 1430.285 297.4245 1490.187 297.9066 1465.971 298.3887 1438.144 298.8708 1429.227 299.3529 1433.737 299.8351 1440.692 300.3172 1446.039 300.7993 1457.816 301.2814 1497.770 301.7635 1571.542 302.2456 1617.916 302.7278 1604.389 303.2099 1561.880 303.6920 1530.262 304.1741 1517.264 304.6562 1514.163 305.1383 1515.168 305.6205 1521.061 306.1026 1516.620 306.5847 1491.940 307.0668 1460.349 307.5489 1436.959 308.0310 1424.034 308.5132 1409.911 308.9953 1382.166 309.4774 1340.582 309.9595 1306.854 310.4416 1291.159 310.9237 1277.222 311.4059 1251.021 311.8880 1212.699 312.3701 1171.450 312.8522 1131.170 313.3343 1093.791 313.8164 1071.062 314.2986 1083.190 314.7807 1091.383 315.2628 1070.674 315.7449 1025.134 316.2270 972.4814 316.7091 921.6250 317.1913 873.3452 317.6734 831.5264 318.1555 800.2964 318.6376 770.1597 319.1197 732.9937 319.6018 694.5513 320.0840 670.8174 320.5661 670.4165 321.0482 682.0972 321.5303 675.2046 322.0124 641.7012 322.4945 607.6006 322.9767 575.3359 323.4588 546.6162 323.9409 524.8203 324.4230 510.9185 324.9051 500.6157 325.3872 491.8540 325.8694 491.7344 326.3515 480.8843 326.8336 446.8398 327.3157 408.0200 327.7978 382.7153 328.2799 377.3311 328.7621 380.8125 329.2442 377.7744 329.7263 365.5586 330.2084 352.4448 330.6905 336.7080 331.1726 321.3677 331.6548 308.2217 332.1369 297.6230 332.6190 289.1885 333.1011 282.6143 333.5832 278.0713 334.0653 274.6914 334.5475 279.4722 335.0296 278.9453 335.5117 262.3657 335.9938 233.8433 336.4759 206.9351 336.9580 193.0479 337.4402 191.8408 337.9223 180.4004 338.4044 139.3193 338.8865 109.3867 339.3686 111.5430 339.8507 130.8257 340.3329 140.1768 340.8150 123.3047 341.2971 87.47314 341.7792 63.86328 342.2613 62.81592 342.7434 62.05957 343.2256 60.92920 343.7077 58.15674 344.1898 49.71533 344.6719 34.26172 345.1540 19.63574 345.6361 24.21240 346.1183 66.93994 346.6004 91.70654 347.0825 80.34863 347.5646 62.49023 348.0467 60.63086 348.5288 78.68799 349.0110 103.1313 349.4931 116.5649 349.9752 115.8730 350.4573 116.6758 350.9394 129.1338 351.4215 134.7769 351.9037 115.3159 352.3858 77.66406 352.8679 49.19629 353.3500 59.90625 353.8321 108.0977 354.3142 135.9629 354.7964 127.6948 355.2785 116.8818 355.7606 123.8921 356.2427 138.0850 356.7248 136.5786 357.2069 99.79688 357.6891 42.71436 358.1712 9.556152 358.6533 9.051270 359.1354 12.95654 359.6175 6.551758 360.0996 0.8037110 360.5818 4.277832 361.0639 30.24268 361.5460 59.46387 362.0281 65.35059 362.5102 44.99414 362.9923 27.83545 363.4745 28.57080 363.9566 33.20801 364.4387 25.41211 364.9208 1.421875 365.4029 18.47803 365.8850 14.93066 366.3672 7.618652 366.8493 24.99121 367.3314 31.80957 367.8135 32.09375 368.2956 28.55518 368.7777 21.56836 369.2599 16.11230 369.7420 19.93848 370.2241 25.07861 370.7062 13.50537 371.1883 20.13330 371.6704 50.80225 372.1526 53.98145 372.6347 34.26562 373.1168 18.62646 373.5989 12.20117 374.0810 9.670898 374.5631 6.232422 375.0453 2.223145 375.5274 0.8935550 376.0095 3.147461 376.4916 10.29541 376.9737 26.56201 377.4558 72.80322 377.9380 103.7368 378.4201 89.13623 378.9022 49.14893 379.3843 24.15625 379.8664 31.16748 380.3485 55.27051 380.8307 66.30664 381.3128 64.53320 381.7949 48.54150 382.2770 7.147949 382.7591 63.25635 383.2412 73.19092 383.7234 32.01416 384.2055 19.73438 384.6876 33.63818 385.1697 1.705078 385.6518 27.13721 386.1339 37.78027 386.6161 44.95703 387.0982 52.48828 387.5803 61.24463 388.0624 71.55420 388.5445 83.81543 389.0266 97.86914 389.5088 111.7358 389.9909 123.9468 390.4730 137.7412 390.9551 155.8862 391.4372 175.1216 391.9193 190.1133 392.4015 198.3398 392.8836 204.9663 393.3657 222.0972 393.8478 256.2715 394.3299 284.4883 394.8120 294.4761 395.2942 304.1616 395.7763 328.5352 396.2584 368.6987 396.7405 409.7573 397.2226 434.0615 397.7047 441.3838 398.1869 459.0068 398.6690 496.0186 399.1511 535.0894 399.6332 569.8887 400.1153 599.2080 400.5974 619.7524 401.0796 620.3867 401.5617 613.7720 402.0438 633.0205 402.5259 686.0112 403.0080 733.7036 403.4901 748.8188 403.9723 747.0146 404.4544 750.7363 404.9365 765.4536 405.4186 783.1514 405.9007 796.5239 406.3828 806.7739 406.8650 821.3701 407.3471 845.9458 407.8292 871.7046 408.3113 881.2266 408.7934 869.8823 409.2755 867.3950 409.7577 894.7363 410.2398 931.5615 410.7219 947.8286 411.2040 938.3203 411.6861 922.0273 412.1682 919.1221 412.6504 932.4526 413.1325 929.8726 413.6146 889.7988 414.0967 854.0996 414.5788 852.8955 415.0609 877.1387 415.5431 896.3979 416.0252 891.7322 416.5073 868.4248 416.9894 850.4636 417.4715 839.1731 417.9536 831.8103 418.4358 830.8213 418.9179 832.6892 419.4000 836.2578 419.8821 840.3105 420.3642 839.2761 420.8463 822.6775 421.3285 781.9338 421.8106 749.8047 422.2927 729.4719 422.7748 714.3340 423.2569 705.4304 423.7390 700.1445 424.2212 689.6455 424.7033 662.8828 425.1854 624.1450 425.6675 601.1052 426.1496 603.4575 426.6317 605.5728 427.1139 593.1621 427.5960 576.4258 428.0781 569.4236 428.5602 579.0920 429.0423 592.9880 429.5244 596.5508 430.0066 591.0598 430.4887 583.2729 430.9708 570.6108 431.4529 560.0557 431.9350 561.1736 432.4171 574.7722 432.8993 585.7432 433.3814 583.7383 433.8635 575.1992 434.3456 572.2227 434.8277 574.7861 435.3098 580.4473 435.7920 592.5039 436.2741 611.8101 436.7562 624.4397 437.2383 616.6316 437.7204 613.7075 438.2025 635.8865 438.6847 676.4268 439.1668 713.8691 439.6489 738.5215 440.1310 755.8950 440.6131 777.3281 441.0952 806.7446 441.5774 835.8608 442.0595 870.2727 442.5416 899.5037 443.0237 912.9326 443.5058 908.4880 443.9879 897.9072 444.4701 895.0193 444.9522 901.9646 445.4343 901.7437 445.9164 892.4846 446.3985 877.6787 446.8806 847.2700 447.3628 813.4473 447.8449 800.5771 448.3270 826.0049 448.8091 869.7832 449.2912 876.9946 449.7733 828.0842 450.2555 796.6235 450.7376 819.5022 451.2197 856.1323 451.7018 877.3879 452.1839 878.7791 452.6660 874.2959 453.1482 869.9927 453.6303 866.2419 454.1124 872.5732 454.5945 896.4834 455.0766 916.8730 455.5587 910.0273 456.0409 884.4810 456.5230 864.4954 457.0051 856.8926 457.4872 856.0806 457.9693 856.9604 458.4514 859.1162 458.9336 864.4443 459.4157 873.2954 459.8978 886.9756 460.3799 912.2178 460.8620 970.5918 461.3441 998.6304 461.8262 970.0872 462.3083 913.9946 462.7905 860.0010 463.2726 813.5718 463.7547 762.9004 464.2368 692.8267 464.7189 598.8687 465.2010 526.1064 465.6832 493.5234 466.1653 461.3083 466.6474 414.8225 467.1295 360.5776 467.6116 308.9729 468.0938 265.5061 468.5759 229.7146 469.0580 200.3625 469.5401 175.6162 470.0222 162.2625 470.5043 181.5618 470.9865 198.1536 471.4686 183.3992 471.9507 137.9956 472.4328 93.37598 472.9149 75.88037 473.3970 78.64575 473.8792 75.21362 474.3613 61.13599 474.8434 49.98267 475.3255 55.96094 475.8076 70.75146 476.2897 76.67334 476.7719 65.14282 477.2540 53.03760 477.7361 51.28735 478.2182 56.38672 478.7003 59.40820 479.1824 56.84717 479.6646 52.40625 480.1467 51.74878 480.6288 55.93359 481.1109 61.45947 481.5930 71.48413 482.0751 79.24902 482.5573 76.42480 483.0394 65.92407 483.5215 60.22241 484.0036 68.88867 484.4857 89.04517 484.9678 101.6484 485.4500 110.9233 485.9321 106.0032 486.4142 65.16675 486.8963 20.23926 487.3784 7.387695 487.8605 33.91870 488.3427 69.81323 488.8248 80.30371 489.3069 65.32690 489.7890 52.91260 490.2711 48.02295 490.7532 37.21655 491.2354 5.930176 491.7175 34.98828 492.1996 61.35254 492.6817 60.97192 493.1638 43.85913 493.6459 18.15356 494.1281 15.18457 494.6102 41.45435 495.0923 56.23779 495.5744 60.37158 496.0565 48.79346 496.5386 15.00879 497.0208 6.954346 497.5029 0.5961910 497.9850 17.72607 498.4671 24.34595 498.9492 19.72388 499.4313 13.49170 499.9135 11.70532 500.3956 15.29712 500.8777 22.66528 501.3598 44.77905 501.8419 59.47681 502.3240 55.78931 502.8062 44.22485 503.2883 36.43164 503.7704 35.79248 504.2525 38.31201 504.7346 39.31152 505.2167 39.10767 505.6989 36.79419 506.1810 27.86743 506.6631 23.01685 507.1452 33.68872 507.6273 54.28516 508.1094 64.98608 508.5916 53.51025 509.0737 33.57202 509.5558 15.18433 510.0379 1.138916 510.5200 0.9765630 511.0021 36.88306 511.4843 82.45996 511.9664 99.54541 512.4485 85.78735 512.9306 70.19092 513.4127 60.07471 513.8948 51.48779 514.3770 36.52832 514.8591 17.10791 515.3412 8.175781 515.8233 21.92651 516.3054 54.02075 516.7875 76.23560 517.2697 83.83179 517.7518 86.98950 518.2339 86.91895 518.7160 82.68677 519.1981 70.46753 519.6802 50.88062 520.1624 32.53687 520.6445 24.42822 521.1266 26.65527 521.6087 36.06372 522.0908 61.98096 522.5729 80.90283 523.0551 76.85938 523.5372 61.43140 524.0193 53.71118 524.5014 62.50073 524.9835 73.29102 525.4656 69.49463 525.9478 54.18872 526.4299 43.96802 526.9120 44.28271 527.3941 47.73755 527.8762 44.91235 528.3583 35.42017 528.8405 29.92847 529.3226 34.36084 529.8047 38.69653 530.2868 33.54272 530.7689 22.63477 531.2510 17.31421 531.7332 23.66089 532.2153 36.90674 532.6974 45.95947 533.1795 53.72266 533.6616 51.24048 534.1437 22.27832 534.6259 2.155273 535.1080 2.932861 535.5901 31.96216 536.0722 59.45312 536.5543 67.82056 537.0364 60.97119 537.5186 47.84717 538.0007 24.50073 538.4828 10.05127 538.9649 19.89404 539.4470 37.53882 539.9291 41.80396 540.4113 28.76245 540.8934 20.85303 541.3755 39.70752 541.8576 66.56885 542.3397 67.05566 542.8218 38.18994 543.3040 11.26514 543.7861 10.92456 544.2682 33.21997 544.7503 44.41187 545.2324 42.63696 545.7145 33.98169 546.1967 8.717529 546.6788 17.62915 547.1609 27.20483 547.6430 16.81934 548.1251 2.689941 548.6072 22.44873 549.0894 42.61914 549.5715 45.05420 550.0536 15.01782 550.5357 8.143311 551.0178 1.624756 551.4999 17.91406 551.9821 25.33643 552.4642 9.096924 552.9463 10.02344 553.4284 10.77075 553.9105 2.147949 554.3926 10.26685 554.8748 9.279053 555.3569 3.703857 555.8390 6.580811 556.3211 21.54858 556.8032 25.78369 557.2853 3.670166 557.7675 12.99316 558.2496 0.4819340 558.7317 27.07104 559.2138 34.77100 559.6959 12.54810 560.1780 21.04663 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