Structure 8104300

8104299 << 8104300 >> 8104301
Original COD entry Download CIF Download DOT

Citation: Evans, H.T. (1979). The crystal structures of low chalcocite and djurleite. Zeitschrift fuer Kristallographie (149,1979-), 150, pp. 299-320.

Formula: Cu31 S16

Cell parameters:

  • a = 13.465 Å
  • b = 15.745 Å
  • c = 30.058 Å
  • α = 90°
  • β = 116.51°
  • 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 S128 (Cu31 S16)

Multiplicity: 1

Coordination sequences:

  • 5, 26, 59, 120, 200, 311, 440, 591, 787, 980
  • 5, 27, 58, 123, 210, 304, 445, 597, 773, 996
  • 5, 28, 59, 132, 213, 311, 445, 605, 792, 1009
  • 5, 28, 61, 134, 217, 324, 471, 616, 794, 1013
  • 6, 26, 61, 125, 217, 318, 445, 604, 795, 1014
  • 6, 26, 64, 122, 202, 316, 444, 604, 793, 990
  • 6, 28, 60, 127, 205, 313, 446, 615, 776, 1005
  • 6, 28, 61, 128, 203, 309, 430, 600, 778, 990
  • 6, 28, 64, 124, 217, 319, 453, 617, 806, 996
  • 6, 28, 64, 126, 214, 329, 470, 619, 800, 996
  • 6, 28, 64, 133, 213, 336, 464, 612, 792, 1028
  • 6, 28, 66, 129, 210, 331, 464, 618, 798, 1007
  • 6, 28, 66, 131, 216, 327, 460, 607, 796, 1006
  • 6, 28, 66, 132, 215, 332, 464, 614, 792, 980
  • 6, 28, 67, 130, 219, 320, 443, 612, 801, 1029
  • 6, 29, 59, 125, 205, 314, 445, 608, 775, 990
  • 6, 29, 60, 129, 211, 321, 456, 606, 787, 1005
  • 6, 29, 62, 129, 214, 305, 457, 609, 792, 998
  • 6, 29, 62, 132, 214, 322, 464, 624, 802, 1022
  • 6, 29, 63, 128, 219, 326, 465, 624, 782, 1003
  • 6, 29, 65, 130, 214, 330, 457, 611, 802, 1014
  • 6, 29, 65, 131, 208, 324, 475, 620, 797, 1004
  • 6, 29, 66, 129, 216, 316, 455, 613, 817, 1012
  • 6, 30, 61, 134, 215, 322, 468, 631, 814, 1008
  • 6, 30, 63, 129, 212, 327, 465, 629, 798, 1019
  • 6, 30, 63, 130, 217, 333, 460, 616, 783, 1001
  • 6, 30, 66, 132, 213, 323, 461, 612, 788, 999
  • 6, 31, 65, 135, 221, 333, 473, 634, 798, 1009
  • 7, 30, 61, 128, 218, 320, 457, 622, 795, 995
  • 7, 30, 71, 134, 221, 330, 457, 618, 799, 1035
  • 7, 31, 63, 133, 223, 321, 460, 613, 789, 1013
  • 7, 33, 71, 136, 240, 349, 481, 660, 829, 1045
  • 7, 33, 72, 137, 223, 342, 484, 628, 826, 1022
  • 8, 28, 75, 135, 225, 339, 464, 625, 829, 1047
  • 8, 29, 71, 140, 217, 330, 462, 625, 821, 1025
  • 8, 30, 75, 133, 225, 343, 480, 624, 817, 1030
  • 8, 31, 75, 144, 228, 349, 470, 646, 843, 1069
  • 8, 32, 72, 137, 223, 331, 481, 636, 828, 1026
  • 8, 32, 74, 145, 241, 343, 496, 650, 837, 1051
  • 8, 33, 72, 137, 231, 332, 478, 646, 839, 1044
  • 8, 33, 74, 144, 231, 360, 488, 662, 834, 1029
  • 8, 33, 75, 141, 230, 351, 491, 650, 829, 1047
  • 9, 28, 77, 135, 232, 342, 464, 631, 836, 1026
  • 9, 29, 75, 137, 226, 334, 462, 615, 821, 1034
  • 9, 30, 72, 146, 225, 331, 462, 628, 809, 1042
  • 9, 30, 73, 146, 229, 343, 492, 659, 838, 1052
  • 9, 30, 74, 139, 229, 338, 479, 646, 830, 1054
  • 9, 30, 76, 140, 235, 345, 494, 654, 828, 1022
  • 9, 31, 69, 135, 225, 336, 472, 652, 807, 1031
  • 9, 31, 69, 141, 231, 340, 481, 625, 804, 1042
  • 9, 31, 75, 138, 231, 337, 471, 633, 825, 1044
  • 9, 32, 72, 153, 236, 348, 499, 652, 836, 1067
  • 9, 32, 76, 139, 233, 349, 483, 633, 825, 1031
  • 9, 32, 79, 142, 232, 347, 496, 663, 836, 1038
  • 9, 32, 79, 150, 242, 352, 481, 648, 852, 1062
  • 9, 32, 80, 140, 238, 359, 494, 670, 856, 1057
  • 9, 32, 80, 144, 238, 349, 499, 665, 851, 1053
  • 9, 32, 83, 142, 245, 352, 490, 664, 867, 1065
  • 9, 33, 80, 143, 235, 349, 498, 653, 853, 1056
  • 9, 33, 80, 153, 242, 350, 480, 668, 852, 1059
  • 9, 34, 84, 141, 236, 362, 492, 664, 820, 1056
  • 9, 35, 80, 145, 234, 351, 495, 657, 843, 1055
  • 9, 36, 78, 148, 240, 352, 486, 647, 845, 1062
  • 9, 36, 78, 149, 228, 354, 496, 665, 850, 1051
  • 10, 30, 80, 142, 231, 344, 483, 646, 838, 1066
  • 10, 31, 75, 144, 234, 347, 484, 649, 839, 1050
  • 10, 31, 79, 145, 241, 359, 485, 639, 828, 1059
  • 10, 32, 80, 145, 221, 347, 473, 639, 844, 1045
  • 10, 32, 82, 144, 244, 355, 499, 664, 853, 1063
  • 10, 33, 76, 146, 238, 361, 491, 658, 825, 1047
  • 10, 33, 77, 142, 231, 353, 482, 653, 850, 1048
  • 10, 33, 78, 144, 233, 350, 491, 659, 830, 1042
  • 10, 33, 78, 151, 242, 353, 483, 654, 850, 1063
  • 10, 33, 79, 143, 243, 358, 499, 660, 829, 1038
  • 10, 33, 79, 144, 233, 343, 483, 646, 835, 1053
  • 10, 33, 82, 146, 242, 350, 493, 661, 840, 1052
  • 10, 34, 79, 149, 246, 349, 498, 654, 861, 1074
  • 10, 34, 82, 152, 234, 356, 492, 658, 845, 1061
  • 10, 35, 82, 154, 246, 358, 511, 669, 842, 1078
  • 11, 32, 80, 144, 232, 347, 486, 657, 849, 1070
  • 11, 33, 75, 150, 238, 353, 502, 648, 852, 1043
  • 11, 34, 82, 138, 238, 356, 491, 655, 851, 1046
  • 11, 34, 84, 147, 237, 355, 506, 667, 853, 1069
  • 11, 35, 81, 149, 243, 365, 500, 653, 856, 1064
  • 11, 35, 83, 149, 248, 360, 514, 666, 864, 1065
  • 11, 35, 84, 151, 237, 370, 503, 673, 857, 1066
  • 11, 35, 86, 157, 252, 368, 501, 674, 860, 1083
  • 11, 36, 81, 156, 247, 363, 501, 653, 850, 1067
  • 11, 36, 82, 153, 247, 368, 504, 683, 861, 1060
  • 11, 36, 84, 163, 247, 350, 492, 668, 884, 1068
  • 11, 36, 88, 160, 255, 383, 521, 681, 881, 1095
  • 11, 37, 84, 159, 244, 367, 508, 677, 866, 1086
  • 11, 37, 88, 154, 258, 372, 521, 661, 866, 1070
  • 12, 36, 91, 160, 250, 368, 522, 684, 873, 1092
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