Structure 9016503

9016502 << 9016503 >> 9016504
Original COD entry Download CIF Download DOT

Citation: Evans, H. T. (1979). Djurleite (Cu1.94S) and low chalcocite (Cu2S): New crystal structure studies. Science, 203, pp. 356-358.

Formula: Cu62 S31

Cell parameters:

  • a = 26.897 Å
  • b = 15.745 Å
  • c = 13.565 Å
  • α = 90°
  • β = 90.13°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: Cu248 S124 (Cu2 S)

Multiplicity: 1

Coordination sequences:

  • 5, 24, 58, 117, 198, 303, 434, 580, 779, 970
  • 5, 27, 56, 122, 209, 301, 440, 591, 761, 987
  • 5, 28, 59, 129, 209, 306, 439, 597, 783, 994
  • 6, 26, 59, 124, 192, 296, 419, 582, 758, 963
  • 6, 26, 61, 123, 215, 313, 439, 601, 785, 998
  • 6, 28, 59, 125, 203, 312, 442, 605, 771, 990
  • 6, 28, 61, 128, 214, 301, 449, 598, 778, 990
  • 6, 28, 63, 124, 212, 327, 463, 611, 787, 986
  • 6, 28, 63, 131, 209, 330, 460, 601, 780, 1016
  • 6, 28, 63, 131, 210, 319, 459, 613, 789, 1002
  • 6, 28, 64, 122, 212, 315, 442, 608, 792, 980
  • 6, 28, 65, 126, 205, 325, 454, 604, 781, 978
  • 6, 28, 65, 130, 206, 323, 468, 610, 791, 991
  • 6, 28, 66, 129, 213, 324, 450, 603, 782, 993
  • 6, 28, 66, 130, 211, 331, 458, 604, 783, 969
  • 6, 28, 67, 127, 217, 315, 437, 606, 795, 1014
  • 6, 29, 59, 123, 204, 308, 441, 603, 764, 972
  • 6, 29, 59, 127, 207, 318, 447, 599, 776, 986
  • 6, 29, 62, 127, 217, 321, 461, 617, 773, 992
  • 6, 29, 62, 129, 209, 324, 459, 617, 791, 1005
  • 6, 29, 63, 127, 210, 325, 445, 602, 789, 1001
  • 6, 29, 66, 128, 212, 313, 451, 608, 809, 997
  • 6, 29, 66, 133, 209, 316, 459, 603, 777, 986
  • 6, 30, 63, 128, 213, 327, 456, 605, 767, 985
  • 6, 30, 63, 135, 225, 328, 474, 609, 795, 1016
  • 6, 31, 65, 131, 221, 327, 467, 622, 787, 1000
  • 7, 29, 61, 126, 215, 320, 451, 611, 785, 978
  • 7, 30, 60, 134, 215, 322, 461, 621, 803, 993
  • 7, 30, 70, 133, 215, 326, 450, 607, 789, 1010
  • 7, 31, 62, 132, 221, 315, 456, 603, 780, 998
  • 7, 32, 70, 136, 238, 345, 476, 644, 820, 1031
  • 7, 33, 71, 136, 218, 344, 476, 620, 809, 1009
  • 7, 33, 73, 134, 230, 327, 470, 643, 823, 1028
  • 8, 28, 73, 132, 221, 333, 457, 619, 816, 1028
  • 8, 29, 71, 138, 213, 326, 458, 618, 814, 1009
  • 8, 30, 74, 132, 221, 339, 470, 618, 806, 1013
  • 8, 31, 71, 137, 221, 330, 473, 629, 817, 1015
  • 8, 31, 74, 143, 227, 345, 461, 642, 831, 1060
  • 8, 32, 72, 144, 238, 338, 490, 635, 819, 1044
  • 8, 32, 79, 143, 233, 344, 491, 644, 841, 1041
  • 8, 33, 74, 140, 232, 354, 478, 655, 821, 1018
  • 8, 33, 75, 137, 225, 345, 479, 638, 817, 1018
  • 8, 34, 79, 146, 230, 346, 489, 646, 831, 1041
  • 9, 28, 74, 133, 226, 336, 454, 616, 824, 1000
  • 9, 29, 74, 137, 227, 337, 471, 637, 824, 1038
  • 9, 29, 75, 134, 223, 330, 453, 607, 811, 1012
  • 9, 30, 68, 134, 223, 335, 464, 642, 799, 1018
  • 9, 30, 70, 146, 224, 324, 458, 618, 804, 1030
  • 9, 30, 72, 144, 228, 340, 487, 648, 828, 1043
  • 9, 30, 75, 138, 234, 341, 488, 649, 812, 1008
  • 9, 30, 75, 139, 229, 337, 463, 632, 823, 1035
  • 9, 31, 69, 140, 226, 335, 475, 620, 787, 1023
  • 9, 31, 74, 137, 229, 332, 465, 630, 814, 1027
  • 9, 31, 79, 146, 240, 345, 471, 640, 839, 1041
  • 9, 32, 74, 138, 231, 343, 473, 624, 817, 1019
  • 9, 32, 77, 142, 229, 342, 490, 651, 815, 1032
  • 9, 32, 78, 141, 237, 353, 490, 658, 849, 1040
  • 9, 32, 79, 141, 236, 343, 494, 651, 836, 1042
  • 9, 32, 82, 140, 243, 349, 485, 658, 858, 1055
  • 9, 33, 75, 141, 232, 348, 474, 648, 837, 1036
  • 9, 33, 79, 151, 240, 346, 475, 663, 841, 1044
  • 9, 34, 79, 142, 243, 351, 493, 655, 840, 1045
  • 9, 34, 83, 139, 234, 356, 485, 656, 804, 1043
  • 9, 35, 75, 143, 233, 342, 474, 631, 826, 1040
  • 9, 36, 78, 146, 226, 350, 494, 655, 837, 1038
  • 10, 30, 71, 150, 231, 344, 491, 636, 815, 1042
  • 10, 30, 74, 144, 232, 341, 477, 641, 826, 1038
  • 10, 30, 78, 140, 225, 339, 477, 635, 824, 1043
  • 10, 31, 79, 143, 237, 355, 479, 631, 814, 1042
  • 10, 31, 79, 144, 219, 343, 465, 632, 828, 1027
  • 10, 32, 77, 143, 231, 337, 478, 637, 825, 1039
  • 10, 32, 78, 141, 231, 343, 484, 641, 824, 1024
  • 10, 32, 82, 152, 241, 360, 483, 657, 846, 1061
  • 10, 33, 76, 143, 235, 359, 481, 650, 814, 1034
  • 10, 33, 78, 142, 239, 356, 490, 650, 820, 1025
  • 10, 33, 81, 146, 237, 346, 486, 657, 826, 1034
  • 10, 34, 77, 148, 243, 340, 497, 642, 847, 1063
  • 10, 34, 81, 152, 229, 352, 491, 649, 835, 1049
  • 10, 35, 81, 153, 242, 353, 508, 659, 834, 1066
  • 11, 31, 80, 143, 229, 341, 482, 649, 838, 1048
  • 11, 32, 74, 150, 234, 350, 497, 639, 845, 1031
  • 11, 32, 84, 146, 235, 351, 497, 657, 843, 1055
  • 11, 34, 80, 136, 230, 349, 478, 643, 828, 1024
  • 11, 34, 84, 148, 236, 366, 494, 663, 848, 1051
  • 11, 35, 81, 147, 240, 359, 496, 642, 844, 1054
  • 11, 35, 82, 148, 245, 357, 508, 656, 849, 1055
  • 11, 35, 83, 149, 245, 365, 495, 674, 842, 1048
  • 11, 36, 81, 152, 245, 355, 493, 644, 836, 1045
  • 11, 36, 83, 160, 245, 347, 488, 662, 873, 1056
  • 11, 36, 87, 157, 251, 378, 510, 667, 859, 1080
  • 11, 37, 82, 157, 242, 362, 502, 667, 853, 1072
  • 11, 37, 86, 153, 255, 366, 516, 645, 854, 1053
  • 12, 36, 90, 158, 245, 363, 517, 678, 858, 1076
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