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"id": "jvasp-115057",
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"updated_at": "2022-09-04T14:38:44.594304Z",
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{
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{
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"structure_string": "Zn1 H1 C2\n1.0\n3.035866 -0.000000 -0.000000\n-0.000000 3.035866 -0.000000\n-0.000000 -0.000000 3.831722\nZn H C\n1 1 2\ndirect\n0.500001 0.500001 0.383968 Zn\n0.000000 0.000000 0.015637 H\n0.000000 0.000000 0.732290 C\n0.500001 0.500001 0.878104 C\n",
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{
"id": "jvasp-114696",
"created_at": "2022-09-04T14:38:42.960790Z",
"updated_at": "2022-09-04T14:38:42.960814Z",
"structure_string": "Zn1 H1 C1\n1.0\n3.473288 0.000000 -0.000000\n-1.736644 3.007955 0.000000\n-0.000000 0.000000 2.770536\nZn H C\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Zn\n0.333334 0.666668 0.000000 H\n0.000000 0.000000 0.000000 C\n",
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"formula_anonymous": "ABC",
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{
"id": "jvasp-120438",
"created_at": "2022-09-04T14:38:50.662667Z",
"updated_at": "2022-09-04T14:38:50.662692Z",
"structure_string": "Zn2 H12 C4\n1.0\n6.900641 0.000000 0.000000\n-0.000000 3.280255 2.146214\n-0.000000 0.035450 7.727036\nZn H C\n2 12 4\ndirect\n0.500000 -0.000000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.677080 0.782727 0.190772 H\n0.822920 0.782727 0.690772 H\n0.322920 0.217275 0.809228 H\n0.177080 0.217275 0.309228 H\n0.808553 0.099506 0.248993 H\n0.691447 0.099506 0.748993 H\n0.308553 0.900495 0.251006 H\n0.873040 0.574937 0.373207 H\n0.626959 0.574937 0.873208 H\n0.126959 0.425064 0.626792 H\n0.373040 0.425064 0.126792 H\n0.191447 0.900495 0.751006 H\n0.678586 0.846053 0.727155 C\n0.321414 0.153948 0.272844 C\n0.178586 0.153948 0.772845 C\n0.821414 0.846053 0.227155 C\n",
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"spacegroup": 14
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{
"id": "jvasp-118070",
"created_at": "2022-09-04T14:38:52.556014Z",
"updated_at": "2022-09-04T14:38:52.556034Z",
"structure_string": "Zn2 H2 Cl2\n1.0\n3.604224 -0.000000 -0.000000\n-1.802112 3.121349 0.000000\n0.000000 0.000000 10.289467\nZn H Cl\n2 2 2\ndirect\n0.333332 0.666667 0.725689 Zn\n0.666665 0.333333 0.274312 Zn\n0.333332 0.666667 0.577415 H\n0.666665 0.333333 0.422586 H\n0.333332 0.666667 0.147709 Cl\n0.666665 0.333333 0.852292 Cl\n",
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"volume": 115.75692539358967,
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"formula_full": "Zn2 H2 Cl2",
"formula_reduced": "ZnHCl",
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"spacegroup": 164
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{
"id": "jvasp-118067",
"created_at": "2022-09-04T14:38:54.134442Z",
"updated_at": "2022-09-04T14:38:54.134469Z",
"structure_string": "Zn1 H1 Cl1\n1.0\n4.234911 -0.000000 -0.000000\n-2.117456 3.667541 0.000000\n0.000000 -0.000000 3.579814\nZn H Cl\n1 1 1\ndirect\n0.666667 0.333334 0.000000 Zn\n0.333334 0.666667 0.000000 H\n0.000000 0.000000 0.000000 Cl\n",
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{
"id": "jvasp-118071",
"created_at": "2022-09-04T14:38:50.460515Z",
"updated_at": "2022-09-04T14:38:50.460541Z",
"structure_string": "Zn2 H3 Cl1\n1.0\n3.185261 0.000000 -0.000000\n-1.592631 2.758517 0.000000\n-0.000000 -0.000000 7.495586\nZn H Cl\n2 3 1\ndirect\n0.666666 0.333333 0.217185 Zn\n0.333332 0.666667 0.782816 Zn\n0.666666 0.333333 0.787800 H\n0.333332 0.666667 0.212200 H\n0.000000 0.000000 0.000000 H\n0.000000 0.000000 0.500000 Cl\n",
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"volume": 65.86069059705594,
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"formula_full": "Zn2 H3 Cl1",
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"spacegroup": 164
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{
"id": "jvasp-118069",
"created_at": "2022-09-04T14:38:54.167036Z",
"updated_at": "2022-09-04T14:38:54.167065Z",
"structure_string": "Zn2 H2 Cl2\n1.0\n3.253048 0.000000 -0.000000\n0.000000 3.253048 0.000000\n-0.000000 -0.000000 7.824261\nZn H Cl\n2 2 2\ndirect\n0.000000 0.500000 0.852596 Zn\n0.500000 0.000000 0.147404 Zn\n0.500000 0.500000 0.000000 H\n0.000000 0.000000 0.000000 H\n0.500000 0.000000 0.681466 Cl\n0.000000 0.500000 0.318535 Cl\n",
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},
{
"id": "jvasp-54743",
"created_at": "2022-09-04T14:38:18.183467Z",
"updated_at": "2022-09-04T14:38:18.183491Z",
"structure_string": "Zn4 H8 O8\n1.0\n0.000000 4.825981 -0.017585\n8.580348 0.000000 0.000000\n0.000000 -0.018190 -5.104011\nZn H O\n4 8 8\ndirect\n0.676532 0.632901 0.642287 Zn\n0.823493 0.380215 0.142204 Zn\n0.176507 0.880215 0.857795 Zn\n0.323468 0.132901 0.357712 Zn\n0.289072 0.416674 0.360030 H\n0.210968 0.596450 0.860155 H\n0.710928 0.916674 0.639969 H\n0.789031 0.096450 0.139844 H\n0.994585 0.909337 0.328935 H\n0.005415 0.409337 0.671064 H\n0.494687 0.603820 0.171181 H\n0.505313 0.103820 0.828818 H\n0.362879 0.675381 0.885270 O\n0.568666 0.533098 0.311597 O\n0.931442 0.480032 0.811538 O\n0.068558 0.980032 0.188461 O\n0.431334 0.033098 0.688402 O\n0.862855 0.837753 0.614863 O\n0.637121 0.175381 0.114729 O\n0.137145 0.337753 0.385136 O\n",
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{
"id": "jvasp-54739",
"created_at": "2022-09-04T14:38:12.287249Z",
"updated_at": "2022-09-04T14:38:12.287279Z",
"structure_string": "Zn4 H8 O8\n1.0\n4.825616 0.000000 0.000000\n0.000000 5.103708 0.000000\n0.000000 0.000000 8.581419\nZn H O\n4 8 8\ndirect\n0.573426 0.642397 0.123674 Zn\n0.426575 0.142397 0.376326 Zn\n0.073426 0.857604 0.876326 Zn\n0.926575 0.357603 0.623674 Zn\n0.961003 0.360290 0.339931 H\n0.038997 0.860290 0.160069 H\n0.538998 0.639710 0.839931 H\n0.461003 0.139710 0.660069 H\n0.255387 0.328711 0.847245 H\n0.244614 0.671289 0.347245 H\n0.755387 0.171289 0.152755 H\n0.744614 0.828712 0.652755 H\n0.887081 0.885364 0.081139 O\n0.681484 0.311741 0.223484 O\n0.318517 0.811741 0.276516 O\n0.181483 0.188260 0.776516 O\n0.818518 0.688260 0.723484 O\n0.387081 0.614636 0.918861 O\n0.612920 0.114636 0.581139 O\n0.112920 0.385364 0.418861 O\n",
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{
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"created_at": "2022-09-04T14:36:54.896452Z",
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"structure_string": "Zn4 H8 O8\n1.0\n4.897610 0.000000 0.000000\n0.000000 5.243935 0.000000\n0.000000 0.000000 8.165770\nZn H O\n4 8 8\ndirect\n0.936268 0.152507 0.873135 Zn\n0.563732 0.847493 0.373135 Zn\n0.436268 0.347493 0.126865 Zn\n0.063732 0.652508 0.626865 Zn\n0.195114 0.929796 0.111476 H\n0.304886 0.070205 0.611476 H\n0.804886 0.429796 0.388524 H\n0.695114 0.570205 0.888524 H\n0.134458 0.639382 0.286031 H\n0.865542 0.139381 0.213969 H\n0.634458 0.860620 0.713969 H\n0.365542 0.360619 0.786031 H\n0.305829 0.668772 0.220594 O\n0.867541 0.606293 0.417262 O\n0.632459 0.393708 0.917262 O\n0.367541 0.893709 0.582738 O\n0.132459 0.106292 0.082738 O\n0.805829 0.831229 0.779406 O\n0.694171 0.168772 0.279406 O\n0.194171 0.331228 0.720594 O\n",
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