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{
"id": "jvasp-45356",
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"structure_string": "Na12 P8 W2\n1.0\n4.567542 -7.911215 0.000000\n4.567542 7.911215 0.000000\n-0.000000 -0.000000 7.142206\nNa P W\n12 8 2\ndirect\n0.706367 0.853184 0.714141 Na\n0.853184 0.706367 0.214141 Na\n0.146816 0.293632 0.714141 Na\n0.146816 0.853184 0.714141 Na\n0.467690 0.532310 0.392481 Na\n0.532310 0.064620 0.892482 Na\n0.293632 0.146816 0.214141 Na\n0.064620 0.532310 0.392481 Na\n0.467690 0.935379 0.392481 Na\n0.532310 0.467690 0.892482 Na\n0.853184 0.146816 0.214141 Na\n0.935379 0.467690 0.892482 Na\n0.387402 0.193701 0.607079 P\n0.806299 0.612598 0.607079 P\n0.333333 0.666667 0.679767 P\n0.666667 0.333333 0.179767 P\n0.806299 0.193701 0.607079 P\n0.193701 0.806299 0.107078 P\n0.612598 0.806299 0.107078 P\n0.193701 0.387402 0.107078 P\n0.666667 0.333333 0.504234 W\n0.333333 0.666667 0.004234 W\n",
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"structure_string": "Mg5 Sn1\n1.0\n5.529216 -0.000000 -0.000000\n-2.764607 4.788441 0.000000\n-0.000000 -0.000000 5.254632\nMg Sn\n5 1\ndirect\n-0.000000 0.335251 0.000000 Mg\n0.664749 0.664749 0.000000 Mg\n0.335251 0.000000 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.333333 0.666667 0.500000 Mg\n0.000000 0.000000 0.500000 Sn\n",
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{
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"structure_string": "Ca3 N2\n1.0\n1.940997 -3.361906 0.000000\n1.940997 3.361906 0.000000\n-0.000000 -0.000000 6.578825\nCa N\n3 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333334 0.339505 Ca\n0.333334 0.666668 0.660495 Ca\n0.666668 0.333334 0.764255 N\n0.333334 0.666668 0.235744 N\n",
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{
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"updated_at": "2022-09-04T14:38:16.402736Z",
"structure_string": "Rb3 Ga1 Cl6\n1.0\n6.593621 -0.000000 3.806829\n2.197874 6.216526 3.806829\n-0.000000 -0.000000 7.613658\nRb Ga Cl\n3 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ga\n0.779042 0.220958 0.220958 Cl\n0.220957 0.220958 0.779043 Cl\n0.220957 0.779043 0.779043 Cl\n0.220957 0.779043 0.220958 Cl\n0.779042 0.220958 0.779043 Cl\n0.779042 0.779043 0.220958 Cl\n",
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{
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"structure_string": "Ca8 P16 O48\n1.0\n7.005128 0.000000 -0.044522\n0.000000 7.722588 0.000000\n0.008751 0.000000 16.960319\nCa P O\n8 16 48\ndirect\n0.524966 0.890944 0.895831 Ca\n0.980632 0.130903 0.172559 Ca\n0.019369 0.630903 0.327441 Ca\n0.019369 0.869097 0.827441 Ca\n0.475035 0.390944 0.604169 Ca\n0.524966 0.609056 0.395831 Ca\n0.475035 0.109056 0.104169 Ca\n0.980632 0.369097 0.672559 Ca\n0.858862 0.297774 0.464177 P\n0.141138 0.797774 0.035823 P\n0.858862 0.202227 0.964177 P\n0.371148 -0.004733 0.305025 P\n0.628852 0.004733 0.694975 P\n0.371148 0.504734 0.805025 P\n0.141138 0.702227 0.535823 P\n0.217715 0.504570 0.143925 P\n0.782285 0.004570 0.356075 P\n0.268273 0.280969 0.412359 P\n0.731727 0.780969 0.087641 P\n0.731727 0.719031 0.587641 P\n0.628852 0.495267 0.194975 P\n0.782285 0.495430 0.856075 P\n0.217715 0.995431 0.643925 P\n0.268273 0.219031 0.912359 P\n0.341984 0.695617 0.816356 O\n0.407696 0.550698 0.191637 O\n0.701862 0.584350 0.114500 O\n0.298138 0.415651 0.885500 O\n0.298360 0.078760 0.231383 O\n0.701640 0.578760 0.268617 O\n0.701640 0.921240 0.768617 O\n0.298360 0.421240 0.731383 O\n0.341984 0.804384 0.316356 O\n0.658016 0.304383 0.183644 O\n0.658016 0.195617 0.683644 O\n0.701862 0.915651 0.614500 O\n0.572496 0.835997 0.032973 O\n0.196147 0.823621 0.951567 O\n0.055665 0.565052 0.193728 O\n0.055665 0.934948 0.693728 O\n0.944335 0.434948 0.806272 O\n0.820337 0.059200 0.906026 O\n0.179663 0.559200 0.593975 O\n0.179663 0.940800 0.093975 O\n0.944335 0.065052 0.306272 O\n0.820337 0.440800 0.406026 O\n0.758882 0.599231 0.656950 O\n0.758882 0.900769 0.156950 O\n0.241118 0.400769 0.343051 O\n0.572495 0.664004 0.532973 O\n0.427505 0.164004 0.967027 O\n0.427505 0.335997 0.467027 O\n0.241118 0.099231 0.843051 O\n0.196147 0.676379 0.451567 O\n0.592304 0.449302 0.808363 O\n0.917709 0.754402 0.035462 O\n0.803853 0.323621 0.548434 O\n0.082291 0.245599 0.964538 O\n0.917709 0.745599 0.535462 O\n0.298138 0.084349 0.385500 O\n0.082291 0.254401 0.464538 O\n0.764872 0.117625 0.435749 O\n0.407696 0.949302 0.691637 O\n0.235128 0.617625 0.064251 O\n0.764872 0.382375 0.935749 O\n0.778614 0.818234 0.381563 O\n0.221387 0.318233 0.118437 O\n0.221387 0.181767 0.618437 O\n0.778614 0.681767 0.881563 O\n0.592304 0.050698 0.308363 O\n0.235128 0.882375 0.564251 O\n0.803853 0.176379 0.048434 O\n",
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{
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"structure_string": "Mo2 H8 O10\n1.0\n-4.000005 -0.192870 -0.075362\n-0.325958 -6.743711 -0.742124\n0.190750 1.089654 7.868225\nMo H O\n2 8 10\ndirect\n0.997720 0.006394 0.238727 Mo\n0.946358 0.013554 0.737531 Mo\n0.175729 0.365318 0.847041 H\n0.741380 0.361930 0.352157 H\n0.137494 0.627223 0.102437 H\n0.890057 0.643178 0.588697 H\n0.716763 0.415531 0.638956 H\n0.545656 0.381653 0.093833 H\n0.613282 0.577553 0.037563 H\n0.411832 0.575300 0.584910 H\n0.002947 0.298198 0.762825 O\n0.001938 0.012388 0.954920 O\n0.958852 0.029303 0.459677 O\n0.441212 0.476771 0.024063 O\n0.628384 0.488726 0.549081 O\n0.429144 0.994720 0.221521 O\n0.514095 0.010060 0.710157 O\n0.929658 0.728405 0.134962 O\n0.836019 0.282562 0.237063 O\n0.082991 0.734705 0.632012 O\n",
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{
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"structure_string": "Ca3 N2\n1.0\n1.941068 -3.362028 0.000000\n1.941068 3.362028 -0.000000\n0.000000 -0.000000 6.579099\nCa N\n3 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333333 0.660508 Ca\n0.333333 0.666668 0.339492 Ca\n0.666668 0.333333 0.235761 N\n0.333333 0.666668 0.764240 N\n",
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{
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"structure_string": "Na10 Mn2 O8\n1.0\n5.801864 0.000000 0.000000\n0.000000 6.013434 0.000000\n0.000000 0.000000 7.766035\nNa Mn O\n10 2 8\ndirect\n0.746592 0.605647 0.697589 Na\n0.740943 0.320762 0.000000 Na\n0.936115 0.071508 0.321533 Na\n0.936115 0.071508 0.678467 Na\n0.436115 0.928491 0.821534 Na\n0.246592 0.394353 0.802412 Na\n0.246592 0.394353 0.197589 Na\n0.436115 0.928491 0.178467 Na\n0.240943 0.679238 0.500000 Na\n0.746592 0.605647 0.302411 Na\n0.494448 0.173810 0.500000 Mn\n0.994447 0.826189 0.000000 Mn\n0.093760 0.742918 0.224793 O\n0.593759 0.257081 0.724793 O\n0.615127 0.875948 0.500000 O\n0.115127 0.124051 0.000000 O\n0.189146 0.286382 0.500000 O\n0.689146 0.713618 0.000000 O\n0.093760 0.742918 0.775208 O\n0.593759 0.257081 0.275207 O\n",
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{
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{
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