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{
"id": "jvasp-29107",
"created_at": "2022-09-04T14:35:50.914414Z",
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"structure_string": "Te6 Mo3 W1 S2\n1.0\n3.477378 0.000003 0.000000\n-1.738685 3.011358 -0.000018\n-0.000002 -0.000233 38.874838\nTe Mo W S\n6 3 1 2\ndirect\n0.333354 0.666710 0.704762 Te\n0.666645 0.333287 0.046784 Te\n0.666646 0.333291 0.421726 Te\n0.666645 0.333290 0.141497 Te\n0.666645 0.333287 0.517156 Te\n0.333353 0.666708 0.610268 Te\n0.333318 0.666636 0.093976 Mo\n0.666686 0.333372 0.281812 Mo\n0.666675 0.333351 0.657632 Mo\n0.333320 0.666639 0.469554 W\n0.333358 0.666717 0.319887 S\n0.333356 0.666715 0.243692 S\n",
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{
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"structure_string": "Na3 Cu2 Sb1 O6\n1.0\n5.201294 0.025473 -1.156823\n-2.506213 4.557741 -1.156823\n-0.037152 -0.063180 5.850876\nNa Cu Sb O\n3 2 1 6\ndirect\n0.826889 0.173110 0.500001 Na\n0.173111 0.826889 0.500001 Na\n0.500000 0.500000 0.500001 Na\n0.333277 0.666723 0.000001 Cu\n0.666723 0.333276 0.000000 Cu\n0.000000 0.000000 0.000000 Sb\n0.035705 0.364568 0.226910 O\n0.254827 0.254827 0.824369 O\n0.745173 0.745172 0.175632 O\n0.364568 0.035704 0.226909 O\n0.964295 0.635431 0.773092 O\n0.635432 0.964295 0.773092 O\n",
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{
"id": "jvasp-28810",
"created_at": "2022-09-04T14:38:34.820245Z",
"updated_at": "2022-09-04T14:38:34.820261Z",
"structure_string": "Te2 Mo3 W1 Se6\n1.0\n3.384755 0.000070 -0.006017\n-1.692316 2.931435 0.014251\n-0.060945 0.131375 33.553630\nTe Mo W Se\n2 3 1 6\ndirect\n0.333900 0.661579 0.733063 Te\n0.334919 0.672203 0.620809 Te\n0.333775 0.664103 0.080340 Mo\n0.666010 0.335225 0.275505 Mo\n0.667739 0.333532 0.676989 Mo\n0.332470 0.667125 0.470089 W\n0.332238 0.664115 0.324797 Se\n0.667550 0.335315 0.031076 Se\n0.666302 0.338395 0.420576 Se\n0.666660 0.326191 0.129649 Se\n0.665313 0.329190 0.519655 Se\n0.333118 0.673024 0.226200 Se\n",
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{
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"structure_string": "Li2 Co6 O4 F12\n1.0\n4.465804 0.011705 0.024019\n0.016842 5.275528 -0.652425\n-0.062247 0.050289 9.890723\nLi Co O F\n2 6 4 12\ndirect\n-0.000020 0.000003 0.000004 Li\n0.499982 -0.000017 0.499993 Li\n0.499997 0.499994 -0.000001 Co\n0.000001 0.500010 0.500001 Co\n0.017898 0.270891 0.755244 Co\n0.982102 0.729110 0.244752 Co\n0.483019 0.273379 0.253659 Co\n0.516985 0.726624 0.746343 Co\n0.815041 0.518181 0.673012 O\n0.321228 0.474524 0.823836 O\n0.678780 0.525463 0.176161 O\n0.184979 0.481837 0.326989 O\n0.707236 0.019492 0.683577 F\n0.199842 0.721700 0.068706 F\n0.689439 0.288429 0.421957 F\n0.310576 0.711577 0.578043 F\n0.800152 0.278292 0.931289 F\n0.300019 0.237213 0.076085 F\n0.810019 0.778021 0.435695 F\n0.189998 0.221998 0.564303 F\n0.699972 0.762787 0.923920 F\n0.786969 0.029372 0.177759 F\n0.292750 0.980520 0.316423 F\n0.213012 0.970613 0.822241 F\n",
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{
"id": "jvasp-111923",
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"structure_string": "Li4 Ni6 O2 F12\n1.0\n5.543691 -0.006718 2.119496\n0.319336 5.972181 2.575446\n-0.059686 0.011177 7.811783\nLi Ni O F\n4 6 2 12\ndirect\n0.316238 0.855772 0.468492 Li\n0.126114 0.301046 0.069506 Li\n0.873886 0.698955 0.930495 Li\n0.683762 0.144228 0.531509 Li\n0.781454 0.569634 0.655440 Ni\n0.925421 0.837139 0.220114 Ni\n0.352424 0.726079 0.931171 Ni\n0.647576 0.273921 0.068830 Ni\n0.074579 0.162861 0.779887 Ni\n0.218546 0.430366 0.344561 Ni\n0.068567 0.584906 0.136270 O\n0.931433 0.415094 0.863731 O\n0.539735 0.563061 0.133976 F\n0.095656 0.705778 0.436793 F\n0.460265 0.436939 0.866025 F\n0.626593 0.719354 0.438514 F\n0.771585 0.986713 0.000578 F\n0.173184 0.863510 0.727609 F\n0.323279 0.153316 0.270060 F\n0.676721 0.846684 0.729940 F\n0.826816 0.136490 0.272392 F\n0.228415 0.013287 0.999423 F\n0.373406 0.280646 0.561487 F\n0.904343 0.294222 0.563207 F\n",
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{
"id": "jvasp-59755",
"created_at": "2022-09-04T14:38:34.588831Z",
"updated_at": "2022-09-04T14:38:34.588861Z",
"structure_string": "Ba2 Y1 Cu3 O6\n1.0\n3.878143 0.000000 0.000000\n-0.000000 3.878143 0.000000\n-0.000000 -0.000000 12.074846\nBa Y Cu O\n2 1 3 6\ndirect\n0.500000 0.500000 0.197430 Ba\n0.500000 0.500000 0.802570 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.368210 Cu\n0.000000 0.000000 0.631790 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.619134 O\n0.000000 0.500000 0.380866 O\n0.000000 0.500000 0.619134 O\n0.000000 0.000000 0.149935 O\n0.500000 0.000000 0.380866 O\n0.000000 0.000000 0.850066 O\n",
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{
"id": "jvasp-29023",
"created_at": "2022-09-04T14:38:34.741837Z",
"updated_at": "2022-09-04T14:38:34.741874Z",
"structure_string": "Te6 Mo1 W3 Se2\n1.0\n3.504538 0.000000 0.000000\n-1.752268 3.035226 -0.004906\n0.000000 -0.058261 35.503220\nTe Mo W Se\n6 1 3 2\ndirect\n0.334918 0.669835 0.724353 Te\n0.665369 0.330737 0.032978 Te\n0.665989 0.331977 0.417075 Te\n0.666881 0.333762 0.136275 Te\n0.668128 0.336253 0.520885 Te\n0.332376 0.664754 0.620587 Te\n0.332788 0.665577 0.084596 Mo\n0.333593 0.667187 0.468968 W\n0.666508 0.333015 0.276840 W\n0.667115 0.334231 0.672520 W\n0.334041 0.668084 0.322522 Se\n0.332297 0.664597 0.231147 Se\n",
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{
"id": "jvasp-119543",
"created_at": "2022-09-04T14:38:35.264377Z",
"updated_at": "2022-09-04T14:38:35.264402Z",
"structure_string": "Li6 Mn4 V2 O12\n1.0\n2.838560 0.000004 -0.000001\n-0.000014 13.206079 3.046011\n0.000003 0.012037 5.789197\nLi Mn V O\n6 4 2 12\ndirect\n1.000001 0.666667 0.166667 Li\n0.500000 0.166666 0.166669 Li\n-0.000000 0.002093 0.489331 Li\n0.500000 0.502093 0.489331 Li\n-0.000000 0.331240 0.844006 Li\n0.500000 0.831241 0.844005 Li\n0.500001 0.507512 -0.004865 Mn\n0.500001 0.825822 0.338200 Mn\n0.000000 0.007511 -0.004865 Mn\n0.000000 0.325822 0.338201 Mn\n0.000000 0.666667 0.666667 V\n0.500000 0.166666 0.666669 V\n-0.000000 0.174265 0.899292 O\n-0.000000 0.507091 0.761529 O\n0.499999 0.007090 0.761529 O\n0.000000 0.826243 0.571807 O\n0.500000 0.326242 0.571808 O\n0.000001 0.829566 0.109296 O\n0.500001 0.329566 0.109297 O\n0.000000 0.503768 0.224040 O\n0.500000 0.003767 0.224040 O\n0.000000 0.159068 0.434046 O\n0.500000 0.659068 0.434044 O\n0.500000 0.674265 0.899291 O\n",
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{
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"created_at": "2022-09-04T14:38:43.627405Z",
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"structure_string": "H4 C12 S2 O6\n1.0\n4.556222 0.048683 1.028947\n0.714764 6.569448 2.047713\n0.179943 -0.056983 9.858585\nH C S O\n4 12 2 6\ndirect\n0.925363 0.610188 0.764022 H\n0.925364 0.110186 0.264023 H\n0.514458 0.821220 0.914292 H\n0.514458 0.321219 0.414292 H\n0.935473 0.663528 0.370992 C\n0.935473 0.163530 0.870991 C\n0.090184 0.072173 0.653253 C\n0.090185 0.572172 0.153253 C\n0.741204 0.336080 0.906653 C\n0.741203 0.836080 0.406653 C\n0.350212 0.533573 0.043039 C\n0.537066 0.156971 0.435162 C\n0.537067 0.656973 0.935162 C\n0.757224 0.043772 0.354458 C\n0.757223 0.543774 0.854458 C\n0.350211 0.033573 0.543039 C\n0.447090 0.279403 0.049829 S\n0.447088 0.779403 0.549829 S\n0.951602 0.492886 0.451432 O\n0.872182 0.482002 0.183908 O\n0.872181 0.982002 0.683908 O\n0.118491 0.705351 0.229303 O\n0.118490 0.205352 0.729302 O\n0.951603 0.992887 0.951431 O\n",
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{
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"created_at": "2022-09-04T14:38:45.354443Z",
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"structure_string": "Li3 Cr2 Co1 O6\n1.0\n6.299404 -0.003175 1.467718\n5.630668 2.824548 1.467718\n0.023790 0.005626 5.784020\nLi Cr Co O\n3 2 1 6\ndirect\n0.162605 0.162607 0.168480 Li\n0.499998 0.500002 0.500000 Li\n0.837391 0.837397 0.831520 Li\n0.164997 0.165000 0.673178 Cr\n0.834999 0.835004 0.326823 Cr\n0.499999 0.500001 0.000000 Co\n0.659704 0.659709 0.908867 O\n0.995898 0.995903 0.229726 O\n0.329110 0.329113 0.568086 O\n0.004098 0.004100 0.770275 O\n0.340293 0.340295 0.091134 O\n0.670886 0.670890 0.431914 O\n",
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{
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"created_at": "2022-09-04T14:36:15.912183Z",
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"structure_string": "Si1 Hg3 S2 F6\n1.0\n7.369246 -0.000000 -0.000000\n-3.684622 6.381954 0.000000\n-0.000000 0.000000 4.566120\nSi Hg S F\n1 3 2 6\ndirect\n0.000000 0.000000 0.500000 Si\n0.500000 0.000000 0.000000 Hg\n-0.000000 0.500000 0.000000 Hg\n0.500000 0.500000 0.000000 Hg\n0.333333 0.666667 0.237335 S\n0.666667 0.333333 0.762665 S\n0.110841 0.889159 0.285744 F\n0.889160 0.110840 0.714256 F\n0.110841 0.221682 0.285744 F\n0.889160 0.778317 0.714256 F\n0.221682 0.110840 0.714256 F\n0.778318 0.889159 0.285744 F\n",
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}