#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-04-26 13:42:33 +0300 (Thu, 26 Apr 2018) $ #$Revision: 518 $ #$URL: svn://172.16.1.111/rod/cif/1/00/00/1000070.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_1000070 loop_ _publ_author_name 'Ercit, T. S.' _publ_section_title ; Caryinite revisited Locality: Langban, Sweden ; _journal_name_full 'Mineralogical Magazine' _journal_page_first 721 _journal_page_last 727 _journal_paper_doi 10.1180/minmag.1993.057.389.16 _journal_volume 57 _journal_year 1993 _chemical_compound_source R060663 _chemical_formula_sum 'As2.892 Ca1.91 Mg0.56 Mn1.77 Na1.376 O12 P0.09 Pb0.384 V0.018' _chemical_name_mineral Caryinite _space_group_IT_number 15 _symmetry_space_group_name_Hall '-I 2ya' _symmetry_space_group_name_H-M 'I 1 2/a 1' _cell_angle_alpha 90 _cell_angle_beta 98.97 _cell_angle_gamma 90 _cell_length_a 6.855 _cell_length_b 13.147 _cell_length_c 11.479 _cell_volume 1021.866 _exptl_crystal_density_diffrn 4.621 _cod_original_formula_sum 'Ca1.91 Na1.376 Pb.384 Mn1.77 Mg.56 (As2.892 P.09 V.018) O12' _cod_database_code 9009485 _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 R060663.rod _rod_data_source.block 3500000 _rod_database.code 1000070 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 9009485 COD http://www.crystallography.net/cod/9009485.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 95.89898 0.0000000E+00 96.38110 1.297638 96.86321 2.678101 97.34533 3.177551 97.82745 1.675201 98.30956 0.4133000 98.79168 1.6357001E-02 99.27380 0.1039430 99.75591 0.5639340 100.2380 1.364838 100.7201 1.993835 101.2023 1.904358 101.6844 1.210327 102.1665 0.9544370 102.6486 1.695343 103.1307 2.862030 103.6128 3.910126 104.0950 4.826294 104.5771 5.619965 105.0592 5.914795 105.5413 6.128876 106.0234 6.511597 106.5055 7.390381 106.9877 8.757904 107.4698 10.09735 107.9519 11.69122 108.4340 13.38635 108.9161 14.59079 109.3982 14.23862 109.8804 13.02731 110.3625 11.82718 110.8446 10.64899 111.3267 9.610199 111.8088 8.393524 112.2909 7.358734 112.7731 6.881165 113.2552 7.067078 113.7373 7.493591 114.2194 7.443817 114.7015 6.322449 115.1836 5.723022 115.6658 6.102417 116.1479 6.746826 116.6300 7.109711 117.1121 6.945679 117.5942 6.312347 118.0763 5.312256 118.5584 3.783386 119.0406 2.348145 119.5227 1.161072 120.0048 0.1701970 120.4869 0.6960750 120.9690 1.561646 121.4511 2.198853 121.9333 2.243195 122.4154 1.471649 122.8975 0.5294490 123.3796 3.0425999E-02 123.8617 0.1597290 124.3438 0.2883000 124.8260 0.6941220 125.3081 1.099213 125.7902 1.271179 126.2723 1.029358 126.7544 0.5920720 127.2365 0.4585880 127.7187 0.6145020 128.2008 1.088562 128.6829 2.072906 129.1650 3.252014 129.6471 4.263580 130.1292 4.846298 130.6114 5.026306 131.0935 5.233658 131.5756 5.284851 132.0577 5.514832 132.5398 6.216965 133.0219 7.193619 133.5041 7.995880 133.9862 8.178482 134.4683 7.581223 134.9504 7.362549 135.4325 7.799332 135.9146 8.325363 136.3968 8.531815 136.8789 8.414627 137.3610 8.327179 137.8431 8.694992 138.3252 9.619614 138.8073 10.59676 139.2895 11.73096 139.7716 12.89943 140.2537 13.98985 140.7358 15.02791 141.2179 15.83792 141.7000 15.96432 142.1821 15.44661 142.6643 15.12761 143.1464 15.49796 143.6285 16.38403 144.1106 17.14217 144.5927 17.53664 145.0748 17.87517 145.5570 18.52032 146.0391 19.46962 146.5212 20.30396 147.0033 20.56691 147.4854 20.18558 147.9675 19.94716 148.4497 20.12343 148.9318 20.41002 149.4139 20.66666 149.8960 20.86078 150.3781 21.02486 150.8602 21.31567 151.3424 22.15532 151.8245 22.11568 152.3066 20.39949 152.7887 18.31198 153.2708 16.92305 153.7529 17.27986 154.2351 18.25005 154.7172 18.70233 155.1993 17.99615 155.6814 17.50677 156.1635 17.58449 156.6456 17.83043 157.1278 17.71884 157.6099 16.96974 158.0920 15.77840 158.5741 14.97691 159.0562 14.87415 159.5383 14.73691 160.0205 14.24100 160.5026 13.57816 160.9847 13.22617 161.4668 13.54314 161.9489 14.33505 162.4310 14.70827 162.9131 14.33087 163.3953 13.88945 163.8774 13.89206 164.3595 14.28421 164.8416 14.48743 165.3237 13.99243 165.8058 13.08194 166.2880 12.42532 166.7701 12.16222 167.2522 12.11047 167.7343 12.08141 168.2164 12.06909 168.6985 12.12062 169.1807 12.34375 169.6628 12.62825 170.1449 12.83014 170.6270 12.83620 171.1091 12.77908 171.5912 12.98161 172.0734 13.59222 172.5555 14.18094 173.0376 14.65236 173.5197 15.00305 174.0018 15.19853 174.4839 15.17270 174.9661 14.97349 175.4482 14.91836 175.9303 15.15067 176.4124 15.37009 176.8945 15.41231 177.3766 15.38449 177.8588 15.48154 178.3409 15.83531 178.8230 16.44362 179.3051 16.98323 179.7872 17.36069 180.2693 17.88091 180.7515 18.87849 181.2336 20.10698 181.7157 20.96191 182.1978 20.87134 182.6799 19.67146 183.1620 19.21846 183.6441 19.90199 184.1263 20.77908 184.6084 21.47072 185.0905 21.94089 185.5726 22.25298 186.0547 22.39038 186.5368 22.30669 187.0190 22.76691 187.5011 24.14754 187.9832 25.76729 188.4653 27.23404 188.9474 28.48486 189.4296 29.47144 189.9117 30.10826 190.3938 30.39252 190.8759 30.51707 191.3580 30.10303 191.8401 29.72307 192.3223 30.20462 192.8044 31.79115 193.2865 33.44116 193.7686 33.93982 194.2507 33.62781 194.7328 33.48097 195.2150 33.85307 195.6971 34.58337 196.1792 35.38818 196.6613 36.28987 197.1434 37.16034 197.6255 37.85291 198.1077 38.43471 198.5898 39.07298 199.0719 40.00713 199.5540 41.11116 200.0361 41.77977 200.5182 41.65216 201.0004 41.54121 201.4825 41.83954 201.9646 42.50229 202.4467 43.41411 202.9288 44.61386 203.4109 46.02481 203.8930 46.96175 204.3752 47.02724 204.8573 47.05457 205.3394 47.35167 205.8215 47.86009 206.3036 48.39618 206.7857 48.83658 207.2679 49.18747 207.7500 49.58618 208.2321 50.06921 208.7142 50.58360 209.1963 51.06705 209.6784 51.52744 210.1606 52.03168 210.6427 52.71571 211.1248 53.64328 211.6069 54.22607 212.0890 54.13670 212.5711 54.07956 213.0533 54.37489 213.5354 54.98964 214.0175 55.71037 214.4996 56.29994 214.9817 56.68948 215.4638 56.79706 215.9460 56.35835 216.4281 56.00420 216.9102 56.13417 217.3923 56.67879 217.8744 57.25177 218.3565 57.50510 218.8387 57.35564 219.3208 56.97624 219.8029 56.28957 220.2850 55.58722 220.7671 54.97318 221.2492 54.42097 221.7314 53.92873 222.2135 53.60320 222.6956 53.51794 223.1777 53.21925 223.6598 52.39906 224.1419 51.48129 224.6240 50.85637 225.1062 50.54004 225.5883 50.20206 226.0704 49.53027 226.5525 48.61763 227.0346 47.94481 227.5167 47.78697 227.9989 47.67624 228.4810 47.12576 228.9631 46.11862 229.4452 45.18576 229.9273 44.90317 230.4094 44.91235 230.8916 44.36308 231.3737 42.65675 231.8558 40.66472 232.3379 39.35591 232.8200 38.77458 233.3021 38.38551 233.7843 38.08888 234.2664 37.77948 234.7485 37.19666 235.2306 36.12334 235.7127 34.80452 236.1948 33.51929 236.6770 32.22978 237.1591 31.21890 237.6412 30.88165 238.1233 30.78458 238.6054 30.48474 239.0875 29.82216 239.5697 28.96083 240.0518 28.10489 240.5339 27.19504 241.0160 26.45911 241.4981 26.22293 241.9802 26.11217 242.4624 25.72134 242.9445 24.87051 243.4266 23.86586 243.9087 23.26457 244.3908 23.23958 244.8729 23.08353 245.3550 22.46394 245.8372 21.73697 246.3193 21.22649 246.8014 21.04701 247.2835 21.00084 247.7656 20.77834 248.2477 20.39893 248.7299 19.76796 249.2120 18.46791 249.6941 17.15987 250.1762 16.45990 250.6583 16.54207 251.1404 16.94215 251.6226 16.86621 252.1047 16.07632 252.5868 15.32887 253.0689 14.72951 253.5510 14.17818 254.0331 13.58958 254.5153 12.94266 254.9974 12.28734 255.4795 11.70503 255.9616 11.23358 256.4437 10.76500 256.9258 10.14406 257.4080 9.618423 257.8901 9.483704 258.3722 9.724213 258.8543 9.948715 259.3364 9.542938 259.8185 7.964035 260.3007 7.168228 260.7828 7.828384 261.2649 8.579880 261.7470 8.501648 262.2291 7.553192 262.7112 6.370560 263.1934 5.701645 263.6755 5.761276 264.1576 5.556793 264.6397 4.975662 265.1218 4.279007 265.6039 3.467422 266.0861 2.629044 266.5682 2.006561 267.0503 1.873520 267.5324 2.332397 268.0145 2.635864 268.4966 2.872635 268.9788 2.913345 269.4609 2.654327 269.9430 2.126724 270.4251 1.403198 270.9072 0.4758300 271.3893 0.6789700 271.8715 1.193039 272.3536 0.5696260 272.8357 5.7510000E-02 273.3178 0.1802520 273.7999 0.1003420 274.2820 0.4597470 274.7642 0.7149510 275.2463 0.8505400 275.7284 0.6532140 276.2105 0.3998570 276.6926 1.147247 277.1747 0.9443050 277.6568 0.1382290 278.1389 0.4443660 278.6211 0.3038790 279.1032 0.3266140 279.5853 0.4293370 280.0674 0.5648500 280.5495 1.307465 281.0316 1.311783 281.5138 0.8557280 281.9959 0.3836820 282.4780 6.1843999E-02 282.9601 9.2666999E-02 283.4422 3.4637000E-02 283.9243 0.6464080 284.4065 1.108032 284.8886 1.168442 285.3707 1.032883 285.8528 1.066422 286.3349 1.417206 286.8170 1.777237 287.2992 1.511612 287.7813 0.3375550 288.2634 0.4364010 288.7455 0.2850190 289.2276 0.2518310 289.7097 0.4769900 290.1919 0.2214360 290.6740 9.0469003E-02 291.1561 0.1385190 291.6382 1.024170 292.1203 1.531952 292.6024 1.220337 293.0846 0.6779630 293.5667 0.5389560 294.0488 0.8742980 294.5309 1.225189 295.0130 1.121246 295.4951 0.5496220 295.9773 0.1716920 296.4594 0.1421200 296.9415 0.2224120 297.4236 0.2047420 297.9057 9.7900003E-02 298.3878 6.1691001E-02 298.8700 0.1980130 299.3521 0.5157470 299.8342 0.9432370 300.3163 1.790039 300.7984 2.475449 301.2805 2.521759 301.7627 2.053802 302.2448 1.638214 302.7269 1.551117 303.2090 1.737335 303.6911 1.983765 304.1732 2.289001 304.6554 2.636414 305.1375 3.095795 305.6196 3.596069 306.1017 3.937286 306.5838 4.021606 307.0659 3.964478 307.5481 3.994934 308.0302 4.150482 308.5123 4.209869 308.9944 4.018768 309.4765 3.705048 309.9586 3.522736 310.4408 3.562439 310.9229 3.650818 311.4050 3.531616 311.8871 3.193085 312.3692 2.964539 312.8513 3.040405 313.3335 3.201904 313.8156 3.227814 314.2977 3.095245 314.7798 2.746033 315.2619 2.045044 315.7440 0.9965210 316.2262 2.6245000E-02 316.7083 1.088165 317.1904 2.031494 317.6725 2.582275 318.1546 2.795288 318.6367 3.155579 319.1188 3.975830 319.6010 5.178864 320.0831 6.373444 320.5652 7.608124 321.0473 8.790588 321.5294 9.860260 322.0115 10.83463 322.4937 11.83917 322.9758 12.93448 323.4579 14.06693 323.9400 15.05121 324.4221 15.84818 324.9042 16.66788 325.3864 17.68594 325.8685 18.78619 326.3506 19.78342 326.8327 20.61603 327.3148 21.30701 327.7969 21.89267 328.2791 22.37460 328.7612 22.70300 329.2433 22.95007 329.7254 23.00769 330.2075 22.70978 330.6896 22.01611 331.1718 21.18994 331.6539 20.51169 332.1360 19.98987 332.6181 19.29898 333.1002 18.17651 333.5823 17.10376 334.0645 16.45474 334.5466 16.20761 335.0287 16.24777 335.5108 16.67041 335.9929 17.30188 336.4750 16.96783 336.9572 14.91605 337.4393 12.84705 337.9214 11.45242 338.4035 10.54358 338.8856 9.663544 339.3677 8.599731 339.8499 7.469116 340.3320 6.583313 340.8141 5.969513 341.2962 5.458557 341.7783 4.949554 342.2604 4.522156 342.7426 4.330109 343.2247 4.419708 343.7068 4.624573 344.1889 4.679291 344.6710 4.426056 345.1531 4.586151 345.6353 5.596893 346.1174 6.768402 346.5995 7.445709 347.0816 7.616272 347.5637 7.841736 348.0458 8.620880 348.5280 9.991089 349.0101 11.40775 349.4922 12.75491 349.9743 14.21231 350.4564 16.00027 350.9385 17.98514 351.4207 19.76086 351.9028 21.00934 352.3849 21.98224 352.8670 23.83939 353.3491 27.41473 353.8312 30.85568 354.3134 33.76117 354.7955 36.46408 355.2776 39.37769 355.7597 42.64334 356.2418 46.12854 356.7239 49.63394 357.2061 53.04910 357.6882 56.72153 358.1703 61.02472 358.6524 65.26624 359.1345 68.97244 359.6166 72.14188 360.0987 74.99908 360.5808 77.77426 361.0630 80.47165 361.5451 82.93387 362.0272 85.20929 362.5093 87.20654 362.9914 89.04645 363.4735 90.57294 363.9557 91.44568 364.4378 91.44806 364.9199 90.72546 365.4020 89.87402 365.8841 89.04007 366.3662 87.83023 366.8484 86.13605 367.3305 84.12296 367.8126 81.80591 368.2947 79.23056 368.7768 76.70010 369.2589 74.75598 369.7411 73.71069 370.2232 72.42572 370.7053 70.34650 371.1874 68.44440 371.6695 67.20660 372.1516 66.65134 372.6338 66.53229 373.1159 66.69370 373.5980 67.12946 374.0801 67.61807 374.5622 67.83655 375.0443 68.53574 375.5265 70.13522 376.0086 72.30276 376.4907 74.52063 376.9728 76.55408 377.4549 78.49673 377.9370 80.40240 378.4192 81.91989 378.9013 84.42746 379.3834 89.38123 379.8655 94.81067 380.3476 99.00671 380.8297 101.6479 381.3119 104.1728 381.7940 108.2752 382.2761 113.9199 382.7582 118.7757 383.2403 121.8221 383.7224 124.8837 384.2046 129.2426 384.6867 134.6485 385.1688 140.2876 385.6509 145.7040 386.1330 151.0027 386.6151 156.4515 387.0973 162.0338 387.5794 167.7612 388.0615 173.6741 388.5436 179.7544 389.0257 185.9874 389.5078 192.3092 389.9900 198.8882 390.4721 205.7922 390.9542 213.0635 391.4363 220.8853 391.9184 229.5272 392.4005 238.5012 392.8827 247.0450 393.3648 255.0981 393.8469 263.4811 394.3290 272.4631 394.8111 281.9774 395.2932 291.8435 395.7754 302.1311 396.2575 312.7148 396.7396 323.6936 397.2217 335.0165 397.7038 346.1029 398.1859 356.6768 398.6681 367.3509 399.1501 378.7457 399.6323 390.6547 400.1144 402.2831 400.5965 413.1616 401.0786 423.6021 401.5607 434.3716 402.0428 445.7180 402.5250 456.9136 403.0071 468.4756 403.4892 479.5349 403.9713 488.6648 404.4534 495.6127 404.9355 501.9131 405.4177 509.3772 405.8998 518.2791 406.3819 526.7927 406.8640 535.5309 407.3461 543.3404 407.8282 549.6259 408.3104 554.5345 408.7925 558.4634 409.2746 561.6418 409.7567 564.1925 410.2388 566.7488 410.7209 569.7412 411.2031 572.1313 411.6852 573.9749 412.1673 575.1229 412.6494 575.3878 413.1315 574.7462 413.6136 573.4097 414.0958 571.6808 414.5779 569.6284 415.0600 566.8535 415.5421 563.5184 416.0242 559.2873 416.5063 553.3607 416.9885 546.3663 417.4706 539.8958 417.9527 535.1324 418.4348 531.4241 418.9169 526.3416 419.3990 519.3329 419.8812 512.2180 420.3633 505.9708 420.8454 499.7044 421.3275 492.5142 421.8096 484.1758 422.2917 475.4901 422.7739 467.3889 423.2560 459.8359 423.7381 451.7671 424.2202 442.9651 424.7023 433.6332 425.1844 423.5955 425.6666 413.1383 426.1487 403.1763 426.6308 394.1923 427.1129 385.7460 427.5950 377.3661 428.0771 369.0090 428.5593 360.8338 429.0414 353.1540 429.5235 345.6014 430.0056 337.4396 430.4877 328.4119 430.9698 319.4271 431.4520 310.8962 431.9341 302.7536 432.4162 294.7637 432.8983 286.8766 433.3804 279.2707 433.8625 272.3103 434.3447 266.1615 434.8268 259.6593 435.3089 252.1532 435.7910 244.6800 436.2731 238.0587 436.7552 232.1922 437.2374 226.4799 437.7195 220.5479 438.2016 214.5170 438.6837 209.0152 439.1658 204.4313 439.6479 199.8504 440.1301 195.0043 440.6122 190.3200 441.0943 186.3727 441.5764 183.1750 442.0585 180.0580 442.5406 176.3173 443.0227 171.8736 443.5049 167.5008 443.9870 162.9589 444.4691 158.7641 444.9512 155.0269 445.4333 151.7783 445.9154 149.1130 446.3976 147.1777 446.8797 145.5720 447.3618 143.2881 447.8439 139.9509 448.3260 137.0775 448.8081 135.3900 449.2903 133.9100 449.7724 131.8386 450.2545 129.2297 450.7366 126.9821 451.2187 126.2614 451.7008 126.5656 452.1830 125.6991 452.6651 123.3114 453.1472 120.5458 453.6293 117.6417 454.1114 114.8874 454.5935 112.8377 455.0757 111.9445 455.5578 111.1426 456.0399 109.4862 456.5220 107.1455 457.0041 104.8298 457.4862 102.7565 457.9684 100.7301 458.4505 98.56943 458.9326 96.30710 459.4147 93.62280 459.8968 90.08459 460.3789 86.38614 460.8611 83.11069 461.3432 80.25516 461.8253 77.59073 462.3074 74.99530 462.7895 72.44058 463.2716 69.71552 463.7538 66.73914 464.2359 63.71347 464.7180 60.59067 465.2001 57.42996 465.6822 54.37024 466.1643 51.38782 466.6465 48.25577 467.1286 44.64722 467.6107 40.40561 468.0928 36.86835 468.5749 34.60315 469.0570 32.44385 469.5392 30.10925 470.0213 27.68546 470.5034 25.39386 470.9855 23.33771 471.4676 21.32391 471.9497 18.90030 472.4319 15.87195 472.9140 13.31158 473.3961 11.48434 473.8782 10.12646 474.3603 9.312592 474.8424 8.907837 475.3246 8.408051 475.8067 7.571930 476.2888 6.431610 476.7709 4.845276 477.2530 2.680847 477.7351 0.9895630 478.2173 0.5671080 478.6994 0.7642820 479.1815 0.5344240 479.6636 0.2593380 480.1457 1.119354 480.6278 1.869781 481.1100 2.501923 481.5920 2.928314 482.0742 3.122101 482.5563 3.409424 483.0384 4.196869 483.5205 5.454041 484.0026 6.133911 484.4847 5.810211 484.9669 5.411346 485.4490 5.327454 485.9311 5.426697 486.4132 5.424042 486.8953 5.217316 487.3774 4.987183 487.8596 5.043640 488.3417 5.558655 488.8238 5.905975 489.3059 6.103485 489.7880 6.145905 490.2701 5.860931 490.7523 5.420135 491.2344 5.227661 491.7165 5.577057 492.1986 6.182251 492.6807 6.192749 493.1628 5.330139 493.6450 4.635925 494.1271 4.514404 494.6092 4.496277 495.0913 4.301483 495.5734 3.905090 496.0555 3.403870 496.5377 2.766174 497.0198 2.079987 497.5019 1.661987 497.9840 1.604919 498.4661 1.388977 498.9482 0.5961910 499.4304 0.4935610 499.9125 1.330109 500.3946 1.815521 500.8767 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