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{
"id": "jvasp-100836",
"created_at": "2022-09-04T14:36:50.906335Z",
"updated_at": "2022-09-04T14:36:50.906355Z",
"structure_string": "Dy1 Zn1 Cu1 As2\n1.0\n4.122225 -0.000000 0.000000\n-2.061112 3.569952 0.000000\n-0.000000 -0.000000 6.723745\nDy Zn Cu As\n1 1 1 2\ndirect\n0.000000 0.000000 0.016715 Dy\n0.333333 0.666666 0.624850 Zn\n0.666666 0.333333 0.354250 Cu\n0.666666 0.333333 0.752421 As\n0.333333 0.666666 0.251763 As\n",
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{
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"structure_string": "Rb2 Cu1 Mo1 Cl6\n1.0\n6.099796 0.000000 3.521719\n2.033265 5.750944 3.521719\n0.000000 0.000000 7.043438\nRb Cu Mo Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Mo\n0.752488 0.247512 0.247512 Cl\n0.247513 0.247512 0.752488 Cl\n0.247513 0.752487 0.752488 Cl\n0.247513 0.752487 0.247513 Cl\n0.752488 0.247512 0.752488 Cl\n0.752489 0.752487 0.247512 Cl\n",
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{
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"created_at": "2022-09-04T14:37:00.696623Z",
"updated_at": "2022-09-04T14:37:00.696647Z",
"structure_string": "K2 P2 H4 O8\n1.0\n-3.699463 3.699463 3.469996\n3.699463 -3.699463 3.469996\n3.699463 3.699463 -3.469996\nK P H O\n2 2 4 8\ndirect\n0.250000 0.750000 0.500000 K\n0.500001 0.500001 0.000000 K\n0.750000 0.250000 0.500000 P\n0.000000 0.000000 0.000000 P\n0.724690 0.125001 0.099690 H\n0.025310 0.624999 0.900309 H\n0.375000 0.275310 0.400310 H\n0.875001 0.974691 0.599690 H\n0.727155 0.290706 0.263658 O\n0.722953 0.959295 0.936449 O\n0.027047 0.463496 0.736342 O\n0.022846 0.786503 0.063551 O\n0.536503 0.272845 0.563550 O\n0.040705 0.977154 0.763657 O\n0.709295 0.972953 0.436449 O\n0.213497 0.277047 0.236342 O\n",
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{
"id": "jvasp-103744",
"created_at": "2022-09-04T14:36:50.988994Z",
"updated_at": "2022-09-04T14:36:50.989017Z",
"structure_string": "Co1 H4 Cl2 O2\n1.0\n3.531260 0.081773 -0.356808\n-0.661240 5.403090 -0.789693\n0.100765 -0.062569 5.499106\nCo H Cl O\n1 4 2 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.837126 0.220078 0.602598 H\n0.162876 0.397404 0.779923 H\n0.837124 0.602596 0.220079 H\n0.162876 0.779921 0.397404 H\n0.559316 0.240844 0.240844 Cl\n0.440684 0.759154 0.759155 Cl\n1.000000 0.760369 0.239630 O\n1.000001 0.239628 0.760372 O\n",
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{
"id": "jvasp-107389",
"created_at": "2022-09-04T14:36:51.563224Z",
"updated_at": "2022-09-04T14:36:51.563242Z",
"structure_string": "K1 Rb2 Co1 F6\n1.0\n5.320036 -0.000000 3.071524\n1.773345 5.015778 3.071524\n-0.000000 -0.000000 6.143049\nK Rb Co F\n1 2 1 6\ndirect\n0.500001 0.500000 0.499999 K\n0.750001 0.750000 0.749998 Rb\n0.250000 0.250000 0.249999 Rb\n0.000000 0.000000 0.000000 Co\n0.785528 0.214473 0.214472 F\n0.785528 0.785527 0.214471 F\n0.214473 0.214473 0.785527 F\n0.214474 0.785527 0.785526 F\n0.785528 0.214473 0.785526 F\n0.214474 0.785527 0.214472 F\n",
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{
"id": "jvasp-104635",
"created_at": "2022-09-04T14:36:51.637964Z",
"updated_at": "2022-09-04T14:36:51.637994Z",
"structure_string": "U2 Mn4 Si2 C2\n1.0\n5.650398 0.006473 0.000000\n-4.406374 3.537076 0.000000\n0.000000 0.000000 6.612596\nU Mn Si C\n2 4 2 2\ndirect\n0.557305 0.442696 0.250000 U\n0.442696 0.557305 0.750000 U\n0.833717 0.166283 0.060657 Mn\n0.166285 0.833718 0.939344 Mn\n0.166285 0.833718 0.560657 Mn\n0.833717 0.166283 0.439343 Mn\n0.275640 0.724362 0.250000 Si\n0.724362 0.275638 0.750000 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
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"formula_full": "U2 Mn4 Si2 C2",
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"spacegroup": 63
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{
"id": "jvasp-47815",
"created_at": "2022-09-04T14:36:43.087370Z",
"updated_at": "2022-09-04T14:36:43.087381Z",
"structure_string": "Li1 Fe1 Si1 O4\n1.0\n-0.000000 4.429907 -0.000000\n2.214953 -2.214954 4.308982\n4.429907 0.000000 -0.000000\nLi Fe Si O\n1 1 1 4\ndirect\n0.500000 0.000000 0.500000 Li\n0.750001 0.500000 0.750000 Fe\n0.000000 0.000000 0.000000 Si\n0.347748 0.217635 0.084518 O\n0.697848 0.782365 0.347748 O\n0.869887 0.217635 0.697847 O\n0.084519 0.782365 0.869886 O\n",
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{
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"created_at": "2022-09-04T14:36:59.181650Z",
"updated_at": "2022-09-04T14:36:59.181676Z",
"structure_string": "Cd1 H20 C12 O4\n1.0\n3.776491 0.025053 0.424300\n1.946874 4.207925 1.376745\n1.263730 0.386175 18.594038\nCd H C O\n1 20 12 4\ndirect\n0.578322 0.791255 0.155972 Cd\n0.095619 0.217191 0.493157 H\n0.351565 0.816253 0.416611 H\n0.185601 0.100647 0.971102 H\n0.678286 0.329160 0.840144 H\n0.157408 0.309541 0.821425 H\n0.608167 0.478004 0.700637 H\n0.060793 0.509307 0.674478 H\n0.494214 0.639703 0.558499 H\n-0.073055 0.703590 0.531750 H\n0.693100 0.176271 0.978156 H\n0.773796 0.894358 0.389781 H\n0.520314 0.761837 0.906518 H\n0.019340 0.688497 0.896340 H\n0.408227 0.911311 0.767999 H\n-0.115636 0.899113 0.748293 H\n0.252920 0.054453 0.631247 H\n0.697548 0.099943 0.606863 H\n0.929096 0.388917 0.352121 H\n0.329982 0.489526 0.331087 H\n0.523967 0.287039 0.467365 H\n0.849057 0.367517 0.048124 C\n0.891862 0.292755 0.973419 C\n0.815772 0.575747 0.901701 C\n0.851472 0.472199 0.830438 C\n0.715513 0.752517 0.758500 C\n0.749886 0.646081 0.687840 C\n0.460541 0.003588 0.405845 C\n0.613117 0.822393 0.546516 C\n0.410098 0.101782 0.478410 C\n0.247908 0.288964 0.339810 C\n0.307421 0.217824 0.264053 C\n0.566758 0.925313 0.618213 C\n0.732620 0.657918 0.047146 O\n0.223316 0.454100 0.202934 O\n0.433085 0.927282 0.264324 O\n0.930481 0.132717 0.109544 O\n",
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{
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"created_at": "2022-09-04T14:36:51.612018Z",
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"structure_string": "Ba2 Na2 B2 O6\n1.0\n5.528362 0.002760 0.755211\n2.684356 4.832911 0.755211\n0.013624 0.008022 6.169039\nBa Na B O\n2 2 2 6\ndirect\n0.833867 0.833866 0.242816 Ba\n0.166133 0.166133 0.757184 Ba\n0.500000 0.500000 0.500000 Na\n0.500000 0.500000 -0.000000 Na\n0.832006 0.832006 0.751375 B\n0.167994 0.167994 0.248625 B\n0.888635 0.316331 0.210560 O\n0.683668 0.111364 0.789440 O\n0.111365 0.683668 0.789440 O\n0.316332 0.888635 0.210560 O\n0.701687 0.701687 0.680635 O\n0.298313 0.298313 0.319365 O\n",
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{
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"structure_string": "Li2 V1 Cr1 O4\n1.0\n5.215158 -0.091867 -0.000000\n2.199809 4.729393 0.000000\n-3.707483 -2.318764 2.843277\nLi V Cr O\n2 1 1 4\ndirect\n0.250001 0.750000 0.500001 Li\n0.500001 0.499999 0.000000 Li\n0.000000 0.000000 0.000000 V\n0.750001 0.250000 0.500001 Cr\n0.519220 0.019219 0.500001 O\n0.232530 0.232530 0.000000 O\n0.980782 0.480781 0.500001 O\n0.767471 0.767469 0.000000 O\n",
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{
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"structure_string": "Li2 Mn1 Fe3 O8\n1.0\n5.702524 0.011385 0.008050\n2.861121 4.932838 0.008050\n2.861121 1.651869 4.648040\nLi Mn Fe O\n2 1 3 8\ndirect\n0.125487 0.125487 0.125487 Li\n0.874512 0.874513 0.874513 Li\n0.500000 0.500000 0.500000 Mn\n-0.000000 0.500000 0.500000 Fe\n0.500000 -0.000000 0.500000 Fe\n0.500000 0.500000 -0.000000 Fe\n0.263072 0.263072 0.263072 O\n0.262238 0.262238 0.713887 O\n0.262238 0.713887 0.262238 O\n0.713887 0.262237 0.262238 O\n0.286112 0.737762 0.737762 O\n0.737762 0.286113 0.737762 O\n0.737762 0.737762 0.286113 O\n0.736928 0.736929 0.736929 O\n",
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{
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"structure_string": "Li1 Co3 O1 F5\n1.0\n4.380752 0.033304 2.475518\n-1.328147 4.717421 -2.551913\n-0.069701 0.057940 5.134928\nLi Co O F\n1 3 1 5\ndirect\n0.138673 0.434276 0.164944 Li\n0.364883 0.023582 0.346217 Co\n0.642375 0.957286 0.625657 Co\n0.829845 0.556294 0.874356 Co\n0.578432 0.760225 0.240891 O\n0.073661 0.255258 0.445306 F\n0.254897 0.765083 0.934934 F\n0.761882 0.243357 0.047005 F\n0.421331 0.266562 0.769623 F\n0.934015 0.738072 0.551074 F\n",
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}