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{
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"structure_string": "K2 B2 C8 N8\n1.0\n6.344802 0.000012 -2.796049\n-1.232181 6.224011 -2.796039\n-0.018166 -0.022130 8.555623\nK B C N\n2 2 8 8\ndirect\n0.625000 0.875000 0.249999 K\n0.374999 0.125000 0.749999 K\n0.874999 0.625000 0.749999 B\n0.125000 0.375000 0.250000 B\n0.699921 0.408333 0.622210 C\n0.213877 0.199921 0.122210 C\n0.077711 0.286123 0.377789 C\n0.922288 0.713877 0.622210 C\n0.091666 0.577711 0.877789 C\n0.786122 0.800078 0.877788 C\n0.300078 0.591666 0.377789 C\n0.908333 0.422289 0.122210 C\n0.749951 0.461414 0.032954 N\n0.716995 0.928459 0.967044 N\n0.961414 0.783003 0.532954 N\n0.283004 0.071540 0.032955 N\n0.250048 0.538585 0.967045 N\n0.571540 0.249951 0.532954 N\n0.038585 0.216996 0.467045 N\n0.428459 0.750049 0.467045 N\n",
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"structure_string": "Cu4 P16 Se16 I4\n1.0\n9.513112 -0.127664 -0.000000\n-2.050875 9.290291 0.000000\n-0.000000 0.000000 12.503787\nCu P Se I\n4 16 16 4\ndirect\n0.904991 0.095009 0.500000 Cu\n0.595009 0.404991 0.000000 Cu\n0.404991 0.595009 0.000000 Cu\n0.095008 0.904991 0.500000 Cu\n0.755783 0.540382 0.259888 P\n0.255784 0.040382 0.240113 P\n0.540382 0.755784 0.259888 P\n0.244216 0.459617 0.740113 P\n0.716152 0.353295 0.145840 P\n0.459617 0.244217 0.740113 P\n0.959617 0.744217 0.759888 P\n0.146705 0.783848 0.645840 P\n0.646706 0.283848 0.854160 P\n0.744216 0.959618 0.759888 P\n0.783848 0.146706 0.645840 P\n0.040382 0.255784 0.240113 P\n0.216152 0.853294 0.354160 P\n0.853294 0.216153 0.354160 P\n0.353294 0.716152 0.145840 P\n0.283847 0.646706 0.854160 P\n0.850752 0.446571 0.407281 Se\n0.553429 0.149248 0.592719 Se\n0.350752 0.946571 0.092719 Se\n0.016576 0.016576 0.190972 Se\n0.149248 0.553429 0.592719 Se\n0.946570 0.350752 0.092719 Se\n0.446570 0.850752 0.407281 Se\n0.983423 0.983424 0.809028 Se\n0.516576 0.516576 0.309028 Se\n0.349444 0.849445 0.750000 Se\n0.053429 0.649248 0.907281 Se\n0.649248 0.053430 0.907281 Se\n0.483423 0.483424 0.690972 Se\n0.650555 0.150556 0.250000 Se\n0.849444 0.349445 0.750000 Se\n0.150555 0.650555 0.250000 Se\n0.310623 0.310623 0.015165 I\n0.810623 0.810623 0.484835 I\n0.189377 0.189377 0.515166 I\n0.689377 0.689377 0.984835 I\n",
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{
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