#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-04-26 14:02:37 +0300 (Thu, 26 Apr 2018) $ #$Revision: 625 $ #$URL: svn://172.16.1.111/rod/cif/1/00/01/1000162.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_1000162 loop_ _publ_author_name 'Kampf, A. R.' 'Housley, R. M.' 'Mills, S. J.' 'Marty, J.' 'Thorne, B.' _publ_section_title ; Lead-tellurium oxysalts from Otto Mountain near Baker, California: I. Ottoite, Pb2TeO5, a new mineral with chains of tellurate octahedra ; _journal_name_full 'American Mineralogist' _journal_page_first 1329 _journal_page_last 1336 _journal_paper_doi 10.2138/am.2010.3510 _journal_volume 95 _journal_year 2010 _chemical_compound_source 'Otto Mountain, Baker, California, USA' _chemical_formula_sum 'O5 Pb2 Te' _chemical_name_mineral Ottoite _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 91.330 _cell_angle_gamma 90 _cell_length_a 7.5353 _cell_length_b 5.7142 _cell_length_c 10.8981 _cell_volume 469.126 _exptl_crystal_density_diffrn 8.807 _cod_original_formula_sum 'Pb2 Te O5' _cod_database_code 9015570 _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 R130126.rod _rod_data_source.block 3500000 _rod_database.code 1000162 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 9015570 COD http://www.crystallography.net/cod/9015570.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 152.4284 0.0000000E+00 152.9105 0.5962830 153.3926 1.063492 153.8747 1.337830 154.3568 0.8592070 154.8389 0.2651820 155.3211 1.6083000E-02 155.8032 3.2607999E-02 156.2853 7.5820997E-02 156.7674 0.1128690 157.2495 2.0111000E-02 157.7316 0.1629180 158.2138 0.2586670 158.6959 0.2460330 159.1780 0.1895290 159.6601 0.1899870 160.1422 0.1715240 160.6243 3.4042001E-02 161.1065 0.5061340 161.5886 1.263840 162.0707 2.273651 162.5528 3.867020 163.0349 5.375336 163.5170 6.241608 163.9991 6.540558 164.4813 6.982315 164.9634 7.927872 165.4455 9.381042 165.9276 11.25677 166.4097 13.63860 166.8918 16.38025 167.3740 19.34021 167.8561 22.52423 168.3382 25.86880 168.8203 29.36798 169.3024 32.97781 169.7845 36.68753 170.2667 40.47433 170.7488 44.35129 171.2309 48.38702 171.7130 52.73509 172.1951 56.94720 172.6772 60.84677 173.1594 64.55722 173.6415 68.27618 174.1236 72.11206 174.6057 76.03992 175.0878 79.85742 175.5699 83.52954 176.0521 87.12067 176.5342 90.54922 177.0163 93.91396 177.4984 97.31851 177.9805 100.8303 178.4626 104.4555 178.9448 108.4236 179.4269 112.6239 179.9090 117.2700 180.3911 122.6512 180.8732 128.5799 181.3553 134.5408 181.8375 140.0729 182.3196 145.0885 182.8017 150.5392 183.2838 156.5182 183.7659 162.7302 184.2480 169.0270 184.7301 175.3985 185.2123 181.9190 185.6944 188.6368 186.1765 195.5835 186.6586 202.5141 187.1407 209.7169 187.6228 216.6514 188.1050 223.1882 188.5871 229.2405 189.0692 234.3123 189.5513 238.1891 190.0334 240.7107 190.5155 240.5107 190.9977 236.6425 191.4798 230.3312 191.9619 222.8825 192.4440 214.4540 192.9261 204.7309 193.4082 192.5320 193.8904 178.5537 194.3725 164.7600 194.8546 151.3910 195.3367 138.6196 195.8188 126.7334 196.3009 115.7839 196.7831 105.7390 197.2652 96.52881 197.7473 88.03600 198.2294 80.30267 198.7115 73.28955 199.1936 66.99623 199.6758 61.53317 200.1579 57.10983 200.6400 53.30409 201.1221 50.00058 201.6042 47.07205 202.0863 44.25986 202.5685 41.31458 203.0506 38.25894 203.5327 35.60698 204.0148 33.62558 204.4969 31.83124 204.9790 29.96945 205.4612 28.13802 205.9433 26.57887 206.4254 25.53635 206.9075 25.03424 207.3896 24.58284 207.8717 24.25243 208.3539 23.91055 208.8360 23.51765 209.3181 23.07826 209.8002 22.59445 210.2823 21.94868 210.7644 21.15274 211.2466 20.83862 211.7287 21.27219 212.2108 21.88997 212.6929 22.42632 213.1750 22.92865 213.6571 23.64081 214.1393 24.79390 214.6214 26.47800 215.1035 28.36324 215.5856 30.41132 216.0677 32.57027 216.5498 34.74178 217.0320 37.00441 217.5141 39.62875 217.9962 42.83310 218.4783 46.65247 218.9604 50.44379 219.4425 54.10555 219.9247 57.86057 220.4068 61.80435 220.8889 65.94258 221.3710 70.27917 221.8531 74.83444 222.3352 79.68661 222.8174 84.84198 223.2995 90.61339 223.7816 96.37813 224.2637 101.6343 224.7458 106.3785 225.2279 110.9173 225.7100 115.4171 226.1922 119.9039 226.6743 124.5909 227.1564 129.5902 227.6385 134.7370 228.1206 139.8345 228.6027 144.8666 229.0849 149.9222 229.5670 154.9981 230.0491 160.1263 230.5312 165.4216 231.0133 170.4020 231.4954 175.8206 231.9776 183.1050 232.4597 192.6231 232.9418 201.4032 233.4239 206.6481 233.9060 210.0891 234.3881 214.3234 234.8703 220.3652 235.3524 227.1663 235.8345 233.3958 236.3166 239.0263 236.7987 244.3289 237.2808 249.7051 237.7630 254.7722 238.2451 259.0987 238.7272 262.6203 239.2093 265.2425 239.6914 266.8314 240.1735 267.4226 240.6557 266.8202 241.1378 265.3933 241.6199 262.6316 242.1020 257.7103 242.5841 250.1899 243.0662 240.9397 243.5484 231.3944 244.0305 221.6886 244.5126 211.3159 244.9947 199.8211 245.4768 187.8603 245.9589 175.8331 246.4410 163.8263 246.9232 152.1310 247.4053 141.0553 247.8874 130.6751 248.3695 120.8614 248.8516 111.5647 249.3337 102.7750 249.8159 94.48448 250.2980 86.68092 250.7801 79.46240 251.2622 72.96146 251.7443 67.40723 252.2264 62.18362 252.7086 57.04630 253.1907 52.26546 253.6728 48.02548 254.1549 44.37830 254.6370 41.19856 255.1191 38.34464 255.6013 36.11089 256.0834 33.58102 256.5655 30.34167 257.0476 27.14224 257.5297 24.45953 258.0118 22.38452 258.4940 20.66876 258.9761 18.95306 259.4582 17.03455 259.9403 15.68484 260.4224 15.21745 260.9045 14.93729 261.3867 14.51448 261.8688 13.86205 262.3509 12.99944 262.8330 11.93321 263.3151 10.62260 263.7972 9.231491 264.2794 7.453613 264.7615 5.865372 265.2436 4.837204 265.7257 4.346649 266.2078 4.129288 266.6899 3.968430 267.1721 3.912048 267.6542 3.569016 268.1363 2.634476 268.6184 1.750381 269.1005 1.253891 269.5826 1.108871 270.0648 1.107040 270.5469 1.118546 271.0290 1.154541 271.5111 0.8212280 271.9932 0.2784580 272.4753 1.276505 272.9575 1.699677 273.4396 1.697128 273.9217 1.748260 274.4038 2.211731 274.8859 3.026489 275.3680 3.403503 275.8501 3.086075 276.3322 2.726425 276.8144 2.547943 277.2965 2.492615 277.7786 2.385345 278.2607 2.103760 278.7428 1.736115 279.2249 1.686249 279.7071 2.364349 280.1892 2.816345 280.6713 2.710831 281.1534 2.230286 281.6355 1.669907 282.1176 1.141785 282.5998 0.6484990 283.0819 0.2121580 283.5640 0.1618500 284.0461 0.5075530 284.5282 0.8418730 285.0103 1.150604 285.4925 1.359360 285.9746 1.422134 286.4567 1.518509 286.9388 1.982437 287.4209 2.879593 287.9030 3.866058 288.3852 4.883545 288.8673 5.963257 289.3494 7.153763 289.8315 8.469193 290.3136 9.830429 290.7957 11.13428 291.2779 12.35065 291.7600 13.72740 292.2421 15.31409 292.7242 17.05731 293.2063 18.87561 293.6884 20.76814 294.1706 22.84149 294.6527 25.22487 295.1348 27.94553 295.6169 30.75252 296.0990 33.23338 296.5811 36.09840 297.0633 40.16060 297.5454 45.33330 298.0275 50.56194 298.5096 55.07866 298.9917 58.98999 299.4738 63.19469 299.9560 68.10103 300.4381 72.88699 300.9202 76.81148 301.4023 80.11057 301.8844 83.89645 302.3665 88.73225 302.8487 94.53735 303.3308 101.0386 303.8129 109.1424 304.2950 116.4875 304.7771 121.3950 305.2592 124.6994 305.7414 128.5479 306.2235 133.7540 306.7056 139.8587 307.1877 146.0444 307.6698 152.3635 308.1519 158.5686 308.6341 164.4572 309.1162 170.1956 309.5983 175.9630 310.0804 181.7542 310.5625 187.7085 311.0446 194.0527 311.5268 200.8153 312.0089 207.4701 312.4910 213.7549 312.9731 219.9450 313.4552 226.5667 313.9373 233.7014 314.4195 240.6374 314.9016 246.5201 315.3837 251.4645 315.8658 257.0528 316.3479 264.5711 316.8300 271.9572 317.3121 277.5410 317.7943 281.3216 318.2764 284.0820 318.7585 286.3950 319.2406 287.9866 319.7227 288.2304 320.2048 287.0545 320.6870 284.6787 321.1691 281.2711 321.6512 276.7883 322.1333 270.9827 322.6154 263.7490 323.0975 255.1092 323.5797 245.2543 324.0618 233.8090 324.5439 222.1786 325.0260 210.8087 325.5081 199.5802 325.9902 188.0730 326.4724 176.0666 326.9545 164.0152 327.4366 152.5591 327.9187 141.6555 328.4008 131.3448 328.8829 121.6631 329.3651 112.5973 329.8472 104.0794 330.3293 96.09904 330.8114 88.77637 331.2935 82.28665 331.7756 76.72130 332.2578 71.27354 332.7399 65.97337 333.2220 60.76570 333.7041 55.27513 334.1862 49.68660 334.6683 45.02509 335.1505 42.26459 335.6326 41.09479 336.1147 39.11075 336.5968 35.58110 337.0789 32.08325 337.5610 29.19347 338.0432 26.80634 338.5253 24.74240 339.0074 22.97760 339.4895 21.38460 339.9716 19.58141 340.4537 17.30818 340.9359 15.32523 341.4180 13.92305 341.9001 12.82680 342.3822 11.66333 342.8643 10.32751 343.3464 9.025131 343.8286 8.058990 344.3107 7.569168 344.7928 7.056152 345.2749 6.635925 345.7570 6.113159 346.2391 5.234207 346.7213 4.040237 347.2034 2.867859 347.6855 2.032883 348.1676 1.551498 348.6497 1.104126 349.1318 0.5300290 349.6140 0.1420440 350.0961 0.2927700 350.5782 0.7462620 351.0603 0.9214320 351.5424 0.4445650 352.0245 0.4888760 352.5067 1.040131 352.9888 0.8623810 353.4709 0.7337040 353.9530 0.7627260 354.4351 0.8829800 354.9172 1.056686 355.3994 1.264511 355.8815 1.422501 356.3636 1.390305 356.8457 1.120621 357.3278 0.7283780 357.8099 0.1354370 358.2920 0.5081790 358.7741 1.089264 359.2563 1.607193 359.7384 2.131485 360.2205 2.724411 360.7026 3.380692 361.1847 4.163116 361.6668 5.291229 362.1490 6.308914 362.6311 6.887756 363.1132 7.259354 363.5953 7.865707 364.0774 8.987930 364.5595 10.51463 365.0417 11.98351 365.5238 13.50392 366.0059 14.78819 366.4880 15.61853 366.9701 16.29997 367.4522 17.09848 367.9344 18.10373 368.4165 19.28419 368.8986 20.65532 369.3807 22.38913 369.8628 23.82883 370.3449 24.67273 370.8271 25.47708 371.3092 26.56589 371.7913 27.91637 372.2734 29.30144 372.7555 30.48807 373.2376 31.48619 373.7198 32.67905 374.2019 34.28218 374.6840 35.82462 375.1661 37.07715 375.6482 38.19006 376.1303 39.42122 376.6125 40.94846 377.0946 42.55684 377.5767 43.76625 378.0588 44.49515 378.5409 45.04373 379.0230 45.51392 379.5052 45.82668 379.9873 45.88939 380.4694 45.68448 380.9515 45.31216 381.4336 44.92752 381.9157 44.52307 382.3979 43.78793 382.8800 42.64212 383.3621 41.16049 383.8442 39.33220 384.3263 37.23788 384.8084 35.10707 385.2906 33.06401 385.7727 31.09042 386.2548 29.11520 386.7369 27.12303 387.2190 25.20833 387.7011 23.42586 388.1833 21.75136 388.6654 20.18193 389.1475 18.79266 389.6296 17.37222 390.1117 15.57179 390.5938 13.47305 391.0760 11.77684 391.5581 10.73726 392.0402 10.19133 392.5223 9.982986 393.0044 10.14383 393.4865 10.19720 393.9687 9.958954 394.4508 9.498978 394.9329 8.819855 395.4150 7.878540 395.8971 7.112366 396.3792 6.986328 396.8614 7.451859 397.3435 7.751099 397.8256 7.609741 398.3077 7.503571 398.7898 7.687531 399.2719 8.159668 399.7540 8.932266 400.2361 10.07397 400.7183 11.41716 401.2004 12.44386 401.6825 12.93257 402.1646 13.54550 402.6467 14.38133 403.1288 15.40834 403.6110 16.75621 404.0931 18.40527 404.5752 19.86520 405.0573 20.48300 405.5394 19.98444 406.0215 20.01346 406.5037 20.76627 406.9858 21.78450 407.4679 22.91478 407.9500 24.13089 408.4321 25.44583 408.9142 26.87350 409.3964 28.37755 409.8785 29.78804 410.3606 31.08366 410.8427 32.31032 411.3248 33.34016 411.8069 34.39787 412.2891 35.77296 412.7712 37.50418 413.2533 39.28716 413.7354 40.65848 414.2175 41.44112 414.6996 42.51569 415.1818 44.27118 415.6639 45.99026 416.1460 47.53764 416.6281 48.81593 417.1102 49.67387 417.5923 50.02325 418.0745 49.88411 418.5566 49.30748 419.0387 48.24040 419.5208 46.86455 420.0029 45.34538 420.4850 43.48566 420.9672 41.04843 421.4493 37.99374 421.9314 34.72394 422.4135 31.38121 422.8956 27.96150 423.3777 25.20868 423.8599 23.66283 424.3420 22.26877 424.8241 20.05914 425.3062 17.25754 425.7883 14.69334 426.2704 12.71465 426.7526 11.20714 427.2347 10.12817 427.7168 9.468628 428.1989 8.703766 428.6810 7.399048 429.1631 5.917252 429.6453 5.037521 430.1274 4.962967 430.6095 5.082642 431.0916 5.171097 431.5737 5.181808 432.0558 5.054611 432.5380 4.768204 433.0201 4.455475 433.5022 4.231781 433.9843 4.092911 434.4664 4.187256 434.9485 4.760178 435.4307 5.372452 435.9128 5.726730 436.3949 5.850113 436.8770 5.909058 437.3591 5.993622 437.8412 6.115875 438.3234 6.307968 438.8055 6.663452 439.2876 6.947128 439.7697 6.959564 440.2518 7.013824 440.7339 7.476654 441.2160 8.375336 441.6982 9.391556 442.1803 10.19827 442.6624 10.82091 443.1445 11.09932 443.6266 10.39198 444.1087 9.988907 444.5909 10.63008 445.0730 11.78462 445.5551 12.54373 446.0372 12.41600 446.5193 11.76012 447.0014 11.35135 447.4836 11.24982 447.9657 11.21512 448.4478 11.24619 448.9299 11.30070 449.4120 11.36853 449.8941 11.44102 450.3763 11.48393 450.8584 11.56490 451.3405 11.61275 451.8226 11.25754 452.3047 10.32600 452.7868 9.414185 453.2690 8.965179 453.7511 8.735291 454.2332 8.380417 454.7153 7.788712 455.1974 7.139786 455.6795 6.616455 456.1617 6.173660 456.6438 5.551620 457.1259 4.585648 457.6080 3.611206 458.0901 3.201706 458.5722 3.361481 459.0544 3.196854 459.5365 2.135773 460.0186 0.9873500 460.5007 0.4631650 460.9828 0.5401920 461.4649 0.8507230 461.9471 1.212387 462.4292 1.593933 462.9113 1.863678 463.3934 2.204346 463.8755 2.207047 464.3576 1.499237 464.8398 0.6041110 465.3219 4.4464000E-02 465.8040 7.8139998E-02 466.2861 4.9026001E-02 466.7682 0.2649690 467.2503 0.6070560 467.7325 0.6642300 468.2146 0.1417240 468.6967 0.3578030 469.1788 0.6959380 469.6609 0.9040370 470.1430 1.044388 470.6252 1.145340 471.1073 1.179214 471.5894 1.060928 472.0715 0.7318730 472.5536 0.5068820 473.0357 0.5110020 473.5179 0.5649410 474.0000 0.5847020 474.4821 0.5654300 474.9642 0.5239110 475.4463 0.4516750 475.9284 0.3687440 476.4106 0.3505710 476.8927 0.4211730 477.3748 0.3851620 477.8569 3.6880001E-02 478.3390 0.5090330 478.8211 0.4372410 479.3033 0.3905490 479.7854 1.068542 480.2675 1.027557 480.7496 0.5609590 481.2317 0.2017670 481.7138 4.6631001E-02 482.1959 0.1092830 482.6780 0.5236510 483.1602 1.170914 483.6423 1.350555 484.1244 0.5679470 484.6065 0.1154940 485.0886 0.2459870 485.5707 8.8040000E-03 486.0529 0.4188390 486.5350 0.8939820 487.0171 1.269394 487.4992 1.229340 487.9813 0.4717860 488.4634 0.1325530 488.9456 0.4747310 489.4277 0.9103090 489.9098 1.184967 490.3919 1.320816 490.8740 1.445740 491.3561 1.647568 491.8383 1.858398 492.3204 1.855148 492.8025 1.517151 493.2846 1.301361 493.7667 1.434982 494.2488 1.630753 494.7310 1.630264 495.2131 1.455414 495.6952 1.432663 496.1773 1.985107 496.6594 2.845306 497.1415 3.198563 497.6237 2.913330 498.1058 2.677933 498.5879 3.018967 499.0700 3.588440 499.5521 3.672272 500.0342 2.991257 500.5164 2.421097 500.9985 2.503983 501.4806 2.958420 501.9627 3.298080 502.4448 3.423950 502.9269 3.448547 503.4091 3.451477 503.8912 3.430939 504.3733 3.538605 504.8554 3.945084 505.3375 4.275299 505.8196 4.333771 506.3018 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