#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-05-24 15:21:51 +0300 (Thu, 24 May 2018) $ #$Revision: 676 $ #$URL: svn://172.16.1.111/rod/cif/2/10/00/2100019.rod $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2100019 loop_ _publ_author_name 'Toman, K.' _publ_section_title ; Ordering in olivenite-adamite solid solutions Locality: Tsumeb, Southwest Africa ; _journal_name_full 'Acta Crystallographica, Section B' _journal_page_first 715 _journal_page_last 721 _journal_paper_doi 10.1107/S0567740878003933 _journal_volume 34 _journal_year 1978 _chemical_compound_source R050583 _chemical_formula_sum 'As Cu0.86 H O5 Zn1.14' _chemical_name_mineral Zincolivenite _space_group_IT_number 58 _symmetry_space_group_name_Hall '-P 2 2n' _symmetry_space_group_name_H-M 'P n n m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 8.50 _cell_length_b 8.52 _cell_length_c 5.99 _cell_volume 433.796 _exptl_crystal_density_diffrn 4.366 _cod_original_formula_sum 'As Zn1.14 Cu.86 O5 H' _cod_database_code 9011188 _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 R050583.rod _rod_data_source.block 3500000 _rod_database.code 2100019 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 9011188 COD http://www.crystallography.net/cod/9011188.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 110.4850 0.0000000E+00 110.9671 45.12244 111.4492 147.8479 111.9313 300.2936 112.4134 514.2642 112.8956 654.4695 113.3777 669.2913 113.8598 602.8267 114.3419 514.4503 114.8240 380.7246 115.3061 253.2560 115.7883 156.4701 116.2704 94.89807 116.7525 57.93335 117.2346 48.03320 117.7167 60.94446 118.1988 83.05481 118.6810 116.0674 119.1631 152.7351 119.6452 186.2535 120.1273 212.3612 120.6094 238.8605 121.0915 270.9552 121.5737 307.5094 122.0558 341.5531 122.5379 370.6873 123.0200 394.3322 123.5021 411.3862 123.9842 414.0603 124.4664 412.6770 124.9485 420.4355 125.4306 440.7429 125.9127 464.4600 126.3948 482.8650 126.8769 496.6177 127.3591 508.9023 127.8412 515.2797 128.3233 521.3779 128.8054 545.8810 129.2875 596.7555 129.7696 662.0127 130.2518 727.4639 130.7339 794.6616 131.2160 859.8723 131.6981 908.0930 132.1802 942.3762 132.6623 991.1111 133.1445 1064.342 133.6266 1163.877 134.1087 1309.927 134.5908 1521.714 135.0729 1736.368 135.5550 1858.708 136.0372 1886.130 136.5193 1842.906 137.0014 1722.003 137.4835 1517.757 137.9656 1324.209 138.4477 1149.355 138.9299 990.2614 139.4120 826.6709 139.8941 647.6296 140.3762 485.8177 140.8583 364.8159 141.3404 294.1232 141.8226 236.7001 142.3047 187.3467 142.7868 146.4425 143.2689 110.8142 143.7510 79.65796 144.2331 54.62158 144.7152 39.25073 145.1974 42.09644 145.6795 41.11462 146.1616 28.59302 146.6437 2.641479 147.1258 27.10706 147.6079 42.71436 148.0901 51.70178 148.5722 59.52917 149.0543 66.50488 149.5364 72.19214 150.0185 76.41199 150.5006 81.83618 150.9828 82.68665 151.4649 77.50598 151.9470 66.73157 152.4291 55.25073 152.9112 43.81995 153.3933 31.55786 153.8755 17.68726 154.3576 3.880127 154.8397 12.95349 155.3218 36.12085 155.8039 67.94421 156.2860 91.91284 156.7682 91.68811 157.2503 85.21802 157.7324 95.01843 158.2145 143.4841 158.6966 195.6140 159.1787 234.8640 159.6609 249.8888 160.1430 273.2255 160.6251 318.9121 161.1072 380.0916 161.5893 441.5071 162.0714 500.8840 162.5536 556.3286 163.0357 605.7246 163.5178 634.7582 163.9999 673.4137 164.4820 739.7837 164.9641 830.4863 165.4463 922.6775 165.9284 1002.638 166.4105 1078.918 166.8926 1160.718 167.3747 1234.608 167.8568 1326.612 168.3390 1455.501 168.8211 1623.878 169.3032 1811.911 169.7853 2032.832 170.2674 2262.565 170.7495 2459.088 171.2317 2606.940 171.7138 2710.809 172.1959 2760.738 172.6780 2740.287 173.1601 2720.139 173.6422 2747.745 174.1244 2822.777 174.6065 2942.537 175.0886 3117.439 175.5707 3333.739 176.0528 3577.510 176.5349 3859.678 177.0171 4144.555 177.4992 4413.420 177.9813 4659.952 178.4634 4850.519 178.9455 4964.252 179.4276 5001.505 179.9098 4965.563 180.3919 4850.841 180.8740 4666.746 181.3561 4407.268 181.8382 4072.241 182.3203 3712.684 182.8025 3366.086 183.2846 3036.574 183.7667 2725.883 184.2488 2433.838 184.7309 2161.077 185.2130 1924.184 185.6951 1720.828 186.1773 1549.052 186.6594 1411.115 187.1415 1305.400 187.6236 1208.091 188.1057 1096.429 188.5878 978.9561 189.0700 895.7152 189.5521 858.5200 190.0342 845.5720 190.5163 815.5847 190.9984 768.7998 191.4805 726.8538 191.9627 707.6018 192.4448 709.2123 192.9269 711.2900 193.4090 707.9199 193.8911 703.9250 194.3732 714.0590 194.8554 739.1409 195.3375 773.9033 195.8196 813.6777 196.3017 858.2135 196.7838 910.8623 197.2659 975.6556 197.7481 1050.204 198.2302 1115.406 198.7123 1169.758 199.1944 1219.413 199.6765 1273.606 200.1586 1335.130 200.6408 1388.149 201.1229 1428.326 201.6050 1454.781 202.0871 1469.114 202.5692 1470.859 203.0513 1461.759 203.5335 1443.285 204.0156 1414.104 204.4977 1380.442 204.9798 1343.603 205.4619 1303.808 205.9440 1262.522 206.4262 1216.713 206.9083 1171.666 207.3904 1142.750 207.8725 1134.463 208.3546 1129.902 208.8367 1117.798 209.3189 1094.447 209.8010 1080.439 210.2831 1076.550 210.7652 1083.219 211.2473 1102.387 211.7294 1134.031 212.2116 1178.494 212.6937 1234.635 213.1758 1301.385 213.6579 1384.003 214.1400 1486.008 214.6221 1607.036 215.1043 1730.475 215.5864 1851.275 216.0685 1983.858 216.5506 2140.482 217.0327 2324.614 217.5148 2527.705 217.9970 2750.683 218.4791 2991.768 218.9612 3249.628 219.4433 3519.373 219.9254 3807.298 220.4075 4122.833 220.8897 4468.353 221.3718 4833.058 221.8539 5216.513 222.3360 5637.242 222.8181 6010.108 223.3002 6337.931 223.7824 6613.371 224.2645 6820.233 224.7466 6972.196 225.2287 7035.328 225.7108 6992.625 226.1929 6826.897 226.6750 6603.282 227.1572 6311.723 227.6393 5968.056 228.1214 5601.375 228.6035 5197.883 229.0856 4796.681 229.5677 4416.563 230.0499 4060.784 230.5320 3729.323 231.0141 3427.064 231.4962 3151.965 231.9783 2888.837 232.4604 2637.713 232.9426 2402.077 233.4247 2179.741 233.9068 1969.855 234.3889 1783.405 234.8710 1626.721 235.3531 1495.970 235.8353 1368.455 236.3174 1241.071 236.7995 1120.519 237.2816 1011.531 237.7637 914.0190 238.2458 828.7039 238.7280 759.2969 239.2101 705.4930 239.6922 646.2203 240.1743 575.4175 240.6564 505.1080 241.1385 447.5111 241.6207 409.5626 242.1028 370.5614 242.5849 325.1276 243.0670 272.3361 243.5491 224.6278 244.0313 182.6738 244.5134 145.2311 244.9955 110.2559 245.4776 74.15552 245.9597 46.97717 246.4418 33.91614 246.9240 38.96875 247.4061 34.38025 247.8882 15.41699 248.3703 9.668213 248.8524 29.06042 249.3345 41.25366 249.8167 50.38440 250.2988 57.45007 250.7809 62.08374 251.2630 66.16003 251.7451 69.54688 252.2272 72.46277 252.7094 75.77625 253.1915 81.83215 253.6736 84.29126 254.1557 79.74976 254.6378 64.48352 255.1199 54.64368 255.6021 55.02478 256.0842 58.60156 256.5663 48.14673 257.0484 14.10925 257.5305 17.50366 258.0126 31.59851 258.4948 13.84387 258.9769 20.72644 259.4590 61.32959 259.9411 123.8508 260.4232 175.6512 260.9053 208.5067 261.3875 245.9971 261.8696 302.3527 262.3517 382.2982 262.8338 462.2625 263.3159 537.3636 263.7980 612.4561 264.2802 701.2916 264.7623 806.7480 265.2444 921.6569 265.7265 1043.345 266.2086 1168.229 266.6907 1305.067 267.1729 1455.397 267.6550 1616.482 268.1371 1781.380 268.6192 1946.647 269.1013 2119.985 269.5834 2305.203 270.0656 2499.651 270.5477 2705.948 271.0298 2921.551 271.5119 3147.305 271.9940 3392.589 272.4761 3655.583 272.9583 3937.985 273.4404 4238.988 273.9225 4553.830 274.4046 4914.580 274.8867 5332.019 275.3688 5798.027 275.8510 6287.873 276.3331 6796.663 276.8152 7336.237 277.2973 7912.282 277.7794 8523.192 278.2615 9192.392 278.7437 9952.318 279.2258 10770.82 279.7079 11520.00 280.1900 12210.83 280.6721 12790.37 281.1542 13234.27 281.6364 13546.73 282.1185 13646.54 282.6006 13501.11 283.0827 13135.07 283.5648 12626.49 284.0469 11965.39 284.5291 11214.22 285.0112 10395.44 285.4933 9512.176 285.9754 8666.296 286.4575 7874.822 286.9396 7146.962 287.4217 6540.348 287.9038 6061.831 288.3860 5653.491 288.8681 5260.148 289.3502 4887.681 289.8323 4557.728 290.3144 4284.472 290.7965 4058.433 291.2787 3861.631 291.7608 3694.219 292.2429 3547.726 292.7250 3422.331 293.2071 3313.041 293.6892 3193.729 294.1714 3052.276 294.6535 2898.795 295.1356 2750.757 295.6177 2607.547 296.0998 2473.017 296.5819 2352.887 297.0641 2243.256 297.5462 2133.067 298.0283 2015.923 298.5104 1897.730 298.9925 1787.883 299.4746 1685.937 299.9568 1586.787 300.4389 1480.121 300.9210 1371.948 301.4031 1273.261 301.8852 1187.934 302.3673 1115.473 302.8495 1055.531 303.3316 1008.502 303.8137 970.0654 304.2958 942.9635 304.7779 921.8503 305.2600 897.2732 305.7422 860.0692 306.2243 819.9941 306.7064 786.2249 307.1885 758.9005 307.6706 738.9220 308.1527 729.8997 308.6349 728.0177 309.1170 727.9441 309.5991 731.5386 310.0812 733.6255 310.5633 728.2454 311.0454 715.8013 311.5276 705.8723 312.0097 704.2354 312.4918 709.2635 312.9739 718.1624 313.4560 722.7350 313.9381 735.9025 314.4203 769.2209 314.9024 822.9607 315.3845 879.0826 315.8666 930.1409 316.3487 976.8662 316.8308 1021.101 317.3130 1055.501 317.7951 1094.639 318.2772 1144.016 318.7593 1203.349 319.2414 1267.311 319.7235 1340.920 320.2057 1414.999 320.6878 1482.285 321.1699 1542.524 321.6520 1594.659 322.1341 1640.963 322.6162 1680.721 323.0984 1703.743 323.5805 1722.817 324.0626 1716.034 324.5447 1668.623 325.0268 1544.556 325.5089 1417.200 325.9911 1295.146 326.4732 1178.921 326.9553 1061.423 327.4374 936.5273 327.9195 814.1794 328.4016 698.5054 328.8838 579.0460 329.3659 479.5996 329.8480 409.1196 330.3301 363.1343 330.8122 311.3530 331.2943 243.8539 331.7765 179.9017 332.2586 130.5204 332.7407 101.4927 333.2228 76.59631 333.7049 54.19312 334.1870 35.15381 334.6692 23.78210 335.1513 25.55029 335.6334 26.07703 336.1155 15.58521 336.5976 12.37439 337.0797 30.67969 337.5619 35.28735 338.0440 30.19226 338.5261 27.55505 339.0082 28.98279 339.4903 28.04028 339.9724 18.83069 340.4546 0.1181640 340.9367 13.92603 341.4188 21.36865 341.9009 25.18262 342.3830 30.96301 342.8651 38.31213 343.3473 48.27075 343.8294 60.31775 344.3115 74.95593 344.7936 95.60815 345.2757 123.9098 345.7578 155.6748 346.2400 186.3923 346.7221 215.2535 347.2042 240.0468 347.6863 257.3871 348.1684 269.8672 348.6505 285.8943 349.1327 306.7506 349.6148 327.5880 350.0969 340.4534 350.5790 347.1182 351.0611 355.7632 351.5432 379.5151 352.0254 405.9299 352.5075 412.0178 352.9896 395.3341 353.4717 374.4205 353.9538 363.5695 354.4359 360.9369 354.9181 363.4529 355.4002 379.0341 355.8823 393.5864 356.3644 388.8389 356.8465 364.4313 357.3286 345.7812 357.8108 349.5211 358.2929 368.7664 358.7750 394.3462 359.2571 429.2377 359.7392 464.3333 360.2213 492.3247 360.7035 513.9326 361.1856 540.2241 361.6677 572.0649 362.1498 612.5730 362.6319 664.7197 363.1140 741.0256 363.5962 817.1033 364.0783 884.2593 364.5604 943.9529 365.0425 1006.826 365.5246 1067.851 366.0067 1137.791 366.4889 1223.029 366.9710 1352.254 367.4531 1464.967 367.9352 1548.772 368.4173 1609.753 368.8994 1674.904 369.3815 1747.944 369.8636 1822.170 370.3458 1894.501 370.8279 1970.803 371.3100 2036.448 371.7921 2092.255 372.2742 2137.731 372.7563 2172.441 373.2385 2197.996 373.7206 2208.725 374.2027 2202.257 374.6848 2178.677 375.1669 2139.549 375.6490 2080.604 376.1312 2009.284 376.6133 1937.365 377.0954 1866.035 377.5775 1791.860 378.0596 1708.480 378.5417 1617.654 379.0239 1542.991 379.5060 1489.463 379.9881 1438.303 380.4702 1366.439 380.9523 1274.221 381.4344 1180.089 381.9166 1084.700 382.3987 993.1362 382.8808 915.3728 383.3629 852.0210 383.8450 793.7655 384.3271 734.6422 384.8093 674.9476 385.2914 615.7874 385.7735 556.0187 386.2556 498.8256 386.7377 450.4545 387.2198 410.7639 387.7020 376.2692 388.1841 348.9983 388.6662 324.6729 389.1483 293.6930 389.6304 239.0909 390.1125 201.8835 390.5947 243.0646 391.0768 333.4667 391.5589 380.5677 392.0410 294.7073 392.5231 175.1034 393.0052 93.99292 393.4874 75.72083 393.9695 68.10718 394.4516 51.58398 394.9337 31.14600 395.4158 16.68945 395.8979 19.14917 396.3801 21.44666 396.8622 14.90393 397.3443 5.445801 397.8264 18.78259 398.3085 14.78064 398.7906 5.088867 399.2728 3.534912 399.7549 21.25159 400.2370 35.03528 400.7191 38.98621 401.2012 32.18677 401.6833 29.17590 402.1655 31.42163 402.6476 35.92371 403.1297 41.07764 403.6118 49.74316 404.0939 51.50598 404.5760 41.98438 405.0582 24.07019 405.5403 14.25122 406.0224 14.62134 406.5045 17.16003 406.9866 17.86267 407.4688 16.95154 407.9509 9.069458 408.4330 8.689697 408.9151 30.46228 409.3972 44.09839 409.8793 49.51428 410.3615 51.63928 410.8436 50.79602 411.3257 48.63806 411.8078 51.20361 412.2899 59.32739 412.7720 70.14490 413.2542 79.50232 413.7363 88.55188 414.2184 100.8953 414.7005 122.4397 415.1826 145.9259 415.6647 163.1019 416.1469 173.5747 416.6290 179.8826 417.1111 179.7511 417.5932 177.5383 418.0753 179.0023 418.5574 190.1381 419.0396 201.7476 419.5217 210.8746 420.0038 217.0883 420.4859 218.1196 420.9680 209.9785 421.4501 198.1719 421.9323 186.6377 422.4144 174.8561 422.8965 164.8138 423.3786 158.9337 423.8607 155.2747 424.3428 148.1587 424.8250 133.9906 425.3071 118.9763 425.7892 105.3026 426.2713 92.77075 426.7534 81.53113 427.2355 72.13281 427.7177 63.63293 428.1998 55.21899 428.6819 47.96960 429.1640 38.00525 429.6461 21.67224 430.1282 0.5192870 430.6104 11.84363 431.0925 9.671265 431.5746 3.478271 432.0567 3.708252 432.5388 10.66418 433.0209 12.86084 433.5031 5.371094 433.9852 6.326050 434.4673 7.381470 434.9494 1.937134 435.4315 12.00134 435.9136 16.40234 436.3958 16.14453 436.8779 12.90027 437.3600 5.676270 437.8421 0.9809570 438.3242 1.746582 438.8063 2.190552 439.2885 7.539673 439.7706 16.86047 440.2527 24.29443 440.7348 23.15051 441.2169 12.19312 441.6990 0.4670410 442.1812 5.496948 442.6633 9.864868 443.1454 17.66321 443.6275 38.42773 444.1096 55.11658 444.5917 59.79749 445.0739 53.20300 445.5560 47.25464 446.0381 42.93945 446.5202 40.90808 447.0023 41.58948 447.4844 47.61182 447.9666 53.05640 448.4487 57.72961 448.9308 61.84143 449.4129 65.91638 449.8950 69.76868 450.3771 73.80042 450.8593 77.72913 451.3413 80.99731 451.8235 87.60010 452.3056 98.47729 452.7877 111.2068 453.2698 124.1263 453.7519 137.8169 454.2340 145.8894 454.7162 143.1029 455.1983 133.0439 455.6804 132.3518 456.1625 142.5131 456.6446 156.5780 457.1267 172.1547 457.6089 185.2319 458.0910 187.2426 458.5731 171.7379 459.0552 155.3036 459.5373 159.4731 460.0194 178.8239 460.5016 196.5227 460.9837 201.6162 461.4658 201.2102 461.9479 201.6840 462.4300 204.2980 462.9121 209.6157 463.3943 219.0046 463.8764 229.4257 464.3585 237.4866 464.8406 236.4529 465.3227 238.8899 465.8048 251.5408 466.2870 274.9757 466.7691 295.1571 467.2512 307.3245 467.7333 317.5605 468.2154 329.0000 468.6975 334.1082 469.1797 353.6052 469.6618 396.4612 470.1439 451.8530 470.6260 488.9652 471.1081 499.4752 471.5902 511.7625 472.0724 538.8365 472.5545 581.9551 473.0366 620.8536 473.5187 652.8062 474.0008 687.0645 474.4829 739.4619 474.9651 808.0415 475.4472 868.2289 475.9293 906.2134 476.4114 935.6073 476.8935 984.0723 477.3756 1050.498 477.8578 1125.897 478.3399 1203.270 478.8220 1285.494 479.3041 1377.750 479.7862 1483.312 480.2683 1593.411 480.7505 1700.090 481.2326 1806.509 481.7147 1919.684 482.1968 2046.088 482.6789 2178.008 483.1610 2316.729 483.6432 2464.713 484.1253 2596.449 484.6074 2702.926 485.0895 2790.162 485.5716 2864.186 486.0537 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