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{
"id": "jvasp-98990",
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{
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"updated_at": "2022-09-04T14:38:45.252363Z",
"structure_string": "Ti4 W1 C5\n1.0\n3.043740 -0.000455 12.332805\n1.498992 2.649033 12.332805\n-0.000780 -0.000455 12.702851\nTi W C\n4 1 5\ndirect\n0.099133 0.099134 0.099133 Ti\n0.699636 0.699639 0.699637 Ti\n0.300362 0.300363 0.300363 Ti\n0.900865 0.900869 0.900866 Ti\n0.499999 0.500001 0.500000 W\n0.600045 0.600048 0.600046 C\n0.399953 0.399955 0.399953 C\n0.000000 0.000000 0.000000 C\n0.200182 0.200183 0.200183 C\n0.799816 0.799819 0.799817 C\n",
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{
"id": "jvasp-30523",
"created_at": "2022-09-04T14:37:15.045987Z",
"updated_at": "2022-09-04T14:37:15.046001Z",
"structure_string": "Ti8 Zn2 O18\n1.0\n4.723199 -0.000000 -0.000000\n0.000000 8.351088 0.000000\n-0.000000 -0.000000 8.351088\nTi Zn O\n8 2 18\ndirect\n0.656256 0.536735 0.343262 Ti\n0.343746 0.843262 0.463266 Ti\n0.656256 0.343262 0.963266 Ti\n0.343746 0.036734 0.843262 Ti\n0.656256 0.963266 0.156738 Ti\n0.656256 0.156739 0.536735 Ti\n0.343746 0.463266 0.656738 Ti\n0.343746 0.656738 0.036734 Ti\n0.894356 0.750000 0.749999 Zn\n0.105645 0.250000 0.250000 Zn\n0.492498 0.855168 0.957921 O\n0.492498 0.542079 0.855168 O\n0.507501 0.457921 0.144832 O\n0.507501 0.355168 0.457921 O\n0.507501 0.144831 0.042080 O\n0.507501 0.042079 0.355168 O\n0.007456 0.183561 0.486973 O\n0.007456 0.013027 0.183561 O\n0.992545 0.513028 0.683561 O\n0.007456 0.316439 0.013027 O\n0.992545 0.816439 0.513027 O\n0.992545 0.986974 0.816439 O\n0.492498 0.644832 0.542079 O\n0.992545 0.683562 0.986974 O\n0.499999 0.250001 0.750000 O\n0.499999 0.750000 0.250000 O\n0.007456 0.486973 0.316439 O\n0.492498 0.957920 0.644832 O\n",
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{
"id": "jvasp-11048",
"created_at": "2022-09-04T14:37:28.232872Z",
"updated_at": "2022-09-04T14:37:28.232898Z",
"structure_string": "Ti4 Zn1 S8\n1.0\n6.963072 0.039113 0.027656\n3.515408 6.088865 0.000000\n3.515408 2.029622 5.740638\nTi Zn S\n4 1 8\ndirect\n0.000000 0.499999 0.500000 Ti\n0.500000 0.499999 0.000000 Ti\n0.500000 0.499999 0.500001 Ti\n0.500000 -0.000001 0.500001 Ti\n0.500000 -0.000000 0.000000 Zn\n0.251190 0.252204 0.252205 S\n0.251190 0.252204 0.744402 S\n0.251190 0.744401 0.252205 S\n0.742099 0.252633 0.252634 S\n0.257902 0.747365 0.747367 S\n0.748811 0.747794 0.255599 S\n0.748811 0.255597 0.747796 S\n0.748811 0.747794 0.747796 S\n",
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"spacegroup": 166
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{
"id": "jvasp-101101",
"created_at": "2022-09-04T14:36:44.004639Z",
"updated_at": "2022-09-04T14:36:44.004667Z",
"structure_string": "Ti5 C1 N4\n1.0\n2.996521 0.001823 12.071129\n1.477403 2.606994 12.071129\n0.003127 0.001823 12.437496\nTi C N\n5 1 4\ndirect\n0.600557 0.600554 0.600558 Ti\n0.000000 0.000000 0.000000 Ti\n0.399445 0.399442 0.399445 Ti\n0.199918 0.199917 0.199918 Ti\n0.800084 0.800079 0.800085 Ti\n0.500001 0.499998 0.500001 C\n0.098953 0.098953 0.098953 N\n0.699833 0.699829 0.699834 N\n0.300169 0.300167 0.300169 N\n0.901049 0.901043 0.901050 N\n",
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{
"id": "jvasp-119073",
"created_at": "2022-09-04T14:38:33.748177Z",
"updated_at": "2022-09-04T14:38:33.748204Z",
"structure_string": "Ti20 Cu8\n1.0\n2.900820 0.000000 0.000000\n0.000000 12.298405 0.000000\n0.000000 0.000000 12.432561\nTi Cu\n20 8\ndirect\n0.500000 0.620871 -0.009669 Ti\n-0.000000 0.610852 0.459941 Ti\n-0.000000 0.389148 0.540059 Ti\n-0.000000 0.110852 0.040059 Ti\n-0.000000 0.889148 0.959941 Ti\n-0.000000 0.803055 0.312581 Ti\n-0.000000 0.196946 0.687419 Ti\n-0.000000 0.696946 0.812581 Ti\n-0.000000 0.510360 0.149973 Ti\n-0.000000 0.489640 0.850027 Ti\n-0.000000 0.303055 0.187419 Ti\n-0.000000 0.989640 0.649973 Ti\n-0.000000 0.010360 0.350027 Ti\n0.500000 0.120871 0.509669 Ti\n0.500000 0.879129 0.490331 Ti\n0.500000 0.572481 0.648844 Ti\n0.500000 0.379129 0.009669 Ti\n0.500000 0.072480 0.851155 Ti\n0.500000 0.927520 0.148844 Ti\n0.500000 0.427520 0.351156 Ti\n0.500000 0.366689 0.725097 Cu\n-0.000000 0.759048 0.618333 Cu\n-0.000000 0.240952 0.381667 Cu\n-0.000000 0.259048 0.881667 Cu\n-0.000000 0.740953 0.118333 Cu\n0.500000 0.866689 0.774903 Cu\n0.500000 0.133312 0.225097 Cu\n0.500000 0.633312 0.274903 Cu\n",
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{
"id": "jvasp-21849",
"created_at": "2022-09-04T14:37:36.203580Z",
"updated_at": "2022-09-04T14:37:36.203597Z",
"structure_string": "Ti10 Cu2 Sb4\n1.0\n4.817208 -0.000000 1.703855\n2.408604 7.404388 0.851927\n-0.060447 -0.000000 7.832526\nTi Cu Sb\n10 2 4\ndirect\n0.573717 0.712706 0.139860 Ti\n0.426282 0.287295 0.860141 Ti\n0.249999 0.500000 0.500001 Ti\n0.750000 0.500000 0.500001 Ti\n0.713576 0.860141 0.712707 Ti\n0.286423 0.139860 0.287295 Ti\n0.926282 0.860141 0.287296 Ti\n0.213576 0.712706 0.860142 Ti\n0.073717 0.139860 0.712706 Ti\n0.786423 0.287295 0.139860 Ti\n0.250000 0.000000 0.000000 Cu\n0.750000 0.000000 0.000000 Cu\n0.336016 0.827967 0.500001 Sb\n0.163983 0.500000 0.172034 Sb\n0.663983 0.172033 0.500001 Sb\n0.836016 0.500000 0.827968 Sb\n",
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{
"id": "jvasp-97829",
"created_at": "2022-09-04T14:35:44.405427Z",
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"structure_string": "Ti10 Fe2 Sb4\n1.0\n4.828759 -0.000000 1.704592\n2.414379 7.394749 0.852296\n-0.047158 0.000000 7.825325\nTi Fe Sb\n10 2 4\ndirect\n0.568642 0.733859 0.128857 Ti\n0.431358 0.266141 0.871144 Ti\n0.250000 0.500000 0.500001 Ti\n0.750000 0.500000 0.500000 Ti\n0.697499 0.871143 0.733860 Ti\n0.302501 0.128857 0.266141 Ti\n0.931358 0.871143 0.266141 Ti\n0.197499 0.733859 0.871144 Ti\n0.068642 0.128857 0.733860 Ti\n0.802501 0.266141 0.128857 Ti\n0.250000 0.000000 -0.000000 Fe\n0.750000 0.000000 -0.000000 Fe\n0.335854 0.828292 0.500001 Sb\n0.164146 0.500000 0.171709 Sb\n0.664146 0.171709 0.500000 Sb\n0.835854 0.500000 0.828292 Sb\n",
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{
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"structure_string": "Ti10 Ga8\n1.0\n3.930338 -6.807546 0.000000\n3.930338 6.807546 0.000000\n-0.000000 0.000000 5.389113\nTi Ga\n10 8\ndirect\n0.333333 0.666667 0.000000 Ti\n0.714428 -0.000000 0.750000 Ti\n-0.000000 0.285573 0.250000 Ti\n-0.000000 0.714428 0.750000 Ti\n0.285573 0.285573 0.750000 Ti\n0.714427 0.714427 0.250000 Ti\n0.333333 0.666667 0.500000 Ti\n0.666667 0.333333 0.000000 Ti\n0.666667 0.333333 0.500000 Ti\n0.285573 -0.000000 0.250000 Ti\n0.377533 0.377533 0.250000 Ga\n0.000000 0.000000 0.000000 Ga\n0.000000 0.000000 0.500000 Ga\n0.622467 -0.000000 0.250000 Ga\n0.622467 0.622467 0.750000 Ga\n-0.000000 0.377533 0.750000 Ga\n-0.000000 0.622467 0.250000 Ga\n0.377533 -0.000000 0.750000 Ga\n",
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{
"id": "jvasp-50733",
"created_at": "2022-09-04T14:36:59.263404Z",
"updated_at": "2022-09-04T14:36:59.263424Z",
"structure_string": "Ti5 Nb1 O12\n1.0\n-4.668105 4.668105 2.997489\n0.010920 4.678158 -2.996125\n-4.678158 -0.010920 -2.996125\nTi Nb O\n5 1 12\ndirect\n0.836936 0.661313 0.661313 Ti\n0.674306 0.337811 0.337811 Ti\n0.325696 0.662189 0.662189 Ti\n0.163066 0.338687 0.338687 Ti\n0.000000 0.000000 0.000000 Ti\n0.500000 0.000000 0.000000 Nb\n0.669796 0.631225 0.029210 O\n0.000001 0.303860 0.696139 O\n0.371238 0.433628 0.433628 O\n0.033748 0.768963 0.768963 O\n0.704954 0.102421 0.102421 O\n0.966254 0.231036 0.231036 O\n0.295048 0.897579 0.897579 O\n0.330206 0.970789 0.368775 O\n0.330206 0.368775 0.970789 O\n0.669796 0.029210 0.631225 O\n0.628764 0.566371 0.566371 O\n0.000001 0.696139 0.303860 O\n",
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{
"id": "jvasp-30214",
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"structure_string": "Ti5 Pb5 O14\n1.0\n-4.008047 7.778486 0.002205\n4.002036 3.885538 -4.150419\n-4.005514 0.000845 -4.152194\nTi Pb O\n5 5 14\ndirect\n0.601511 0.296228 0.212176 Ti\n0.405827 0.685217 0.821578 Ti\n0.798657 0.903717 0.604853 Ti\n0.994112 0.511699 0.004009 Ti\n0.190600 0.122894 0.384318 Ti\n0.795527 0.416767 0.627291 Pb\n0.392028 0.207947 0.813232 Pb\n0.201702 0.637722 0.432800 Pb\n0.576879 0.815142 0.245830 Pb\n0.989394 0.015774 0.013870 Pb\n0.110564 0.281733 0.157079 O\n0.413576 0.167319 0.270026 O\n0.813626 0.372011 0.059846 O\n0.608525 0.776697 0.661981 O\n0.115947 0.267399 0.668866 O\n0.211956 0.580597 0.856933 O\n0.912116 0.676669 0.762473 O\n0.515293 0.468658 0.477222 O\n0.510932 0.473306 0.975252 O\n0.712711 0.074993 0.367345 O\n0.306035 0.888721 0.048894 O\n0.711820 0.078106 0.864753 O\n0.908465 0.679471 0.266640 O\n0.014908 0.975808 0.464615 O\n",
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}
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}