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{
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{
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"formula_full": "Pr2 Co1 Ge3",
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{
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"structure_string": "Cs4\n1.0\n5.354405 0.000000 0.000000\n0.000000 8.731849 0.000000\n0.000000 0.000000 10.022037\nCs\n4\ndirect\n0.732089 0.750000 0.391224 Cs\n0.267911 0.250000 0.608776 Cs\n0.732089 0.250000 0.108776 Cs\n0.267911 0.750000 0.891224 Cs\n",
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{
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"structure_string": "Li8 Mn2 V2 P6 O24\n1.0\n8.415449 0.000000 0.000000\n-4.141997 7.350062 0.000000\n-0.060616 -4.835775 7.944744\nLi Mn V P O\n8 2 2 6 24\ndirect\n0.735506 0.532756 0.135388 Li\n0.056517 0.169392 0.097379 Li\n0.341444 0.780870 0.147061 Li\n0.201667 0.849977 0.409372 Li\n0.798333 0.150023 0.590628 Li\n0.658556 0.219130 0.852939 Li\n0.943483 0.830608 0.902621 Li\n0.264494 0.467244 0.864612 Li\n0.849941 0.589206 0.561778 Mn\n0.150059 0.410794 0.438222 Mn\n0.351657 0.621492 0.034900 V\n0.648343 0.378508 0.965100 V\n0.050626 0.293172 0.245910 P\n0.453024 0.013877 0.246365 P\n0.745421 0.715227 0.238069 P\n0.254579 0.284773 0.761931 P\n0.546976 0.986123 0.753635 P\n0.949374 0.706828 0.754090 P\n0.849507 0.424010 0.106909 O\n0.496764 0.301946 0.178847 O\n0.167777 0.314298 0.182972 O\n0.445738 0.104708 0.100751 O\n0.790263 0.056154 0.100771 O\n0.248950 0.890421 0.267720 O\n0.032706 0.971662 0.412071 O\n0.602222 0.802753 0.407120 O\n0.527656 0.659562 0.176870 O\n0.866262 0.614477 0.244692 O\n0.791844 0.563746 0.408636 O\n0.147850 0.490785 0.254194 O\n0.852150 0.509215 0.745806 O\n0.208156 0.436254 0.591364 O\n0.133738 0.385523 0.755308 O\n0.472344 0.340438 0.823130 O\n0.397778 0.197247 0.592880 O\n0.967294 0.028338 0.587929 O\n0.751050 0.109579 0.732280 O\n0.209737 0.943846 0.899229 O\n0.554262 0.895292 0.899249 O\n0.832223 0.685702 0.817028 O\n0.503236 0.698054 0.821153 O\n0.150493 0.575990 0.893091 O\n",
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"formula_full": "Li8 Mn2 V2 P6 O24",
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"spacegroup": 2
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{
"id": "mp-560973",
"created_at": "2022-09-04T14:46:10.030469Z",
"structure_string": "Si18 O36\n1.0\n3.783736 -9.504460 0.000000\n3.783737 9.504460 0.000000\n0.000000 0.000000 14.143753\nSi O\n18 36\ndirect\n0.530438 0.883102 0.949019 Si\n0.079663 0.920338 0.540018 Si\n0.469562 0.116898 0.449019 Si\n0.883102 0.530438 0.449019 Si\n0.139747 0.860253 0.750000 Si\n0.116898 0.469562 0.550981 Si\n0.469562 0.116898 0.050981 Si\n0.860253 0.139747 0.250000 Si\n0.033766 0.558180 0.250000 Si\n0.116898 0.469562 0.949019 Si\n0.966234 0.441820 0.750000 Si\n0.883102 0.530438 0.050981 Si\n0.558180 0.033766 0.750000 Si\n0.920337 0.079663 0.040018 Si\n0.920337 0.079663 0.459982 Si\n0.079663 0.920338 0.959982 Si\n0.530438 0.883102 0.550981 Si\n0.441820 0.966234 0.250000 Si\n0.655747 0.344253 0.040506 O\n0.344253 0.655747 0.540506 O\n0.000000 0.500000 0.500000 O\n0.572961 0.944882 0.838915 O\n0.635213 0.018263 0.250000 O\n0.063800 0.293881 0.501595 O\n0.089080 0.910921 0.655809 O\n0.572961 0.944882 0.661085 O\n0.089080 0.910921 0.844191 O\n0.706119 0.936200 0.998405 O\n0.000000 0.000000 0.000000 O\n0.981737 0.364787 0.250000 O\n0.293881 0.063800 0.001595 O\n0.936200 0.706119 0.001595 O\n0.055118 0.427039 0.661085 O\n0.910921 0.089080 0.155809 O\n0.706119 0.936200 0.501595 O\n0.265208 0.734792 0.250000 O\n0.910921 0.089080 0.344191 O\n0.734792 0.265208 0.750000 O\n0.944882 0.572961 0.338915 O\n0.655747 0.344253 0.459494 O\n0.500000 0.000000 0.000000 O\n0.055118 0.427039 0.838915 O\n0.936200 0.706119 0.498405 O\n0.944882 0.572961 0.161085 O\n0.293881 0.063800 0.498405 O\n0.344253 0.655747 0.959494 O\n0.000000 0.000000 0.500000 O\n0.364787 0.981737 0.750000 O\n0.427039 0.055118 0.338915 O\n0.427039 0.055118 0.161085 O\n0.018263 0.635213 0.750000 O\n0.000000 0.500000 0.000000 O\n0.063800 0.293881 0.998405 O\n0.500000 0.000000 0.500000 O\n",
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{
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{
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"structure_string": "Li9 Mn7 O16\n1.0\n2.883199 5.846105 0.000000\n-2.883199 5.846105 0.000000\n0.000000 5.749200 8.845555\nLi Mn O\n9 7 16\ndirect\n0.250781 0.742662 0.758606 Li\n0.257338 0.749219 0.241394 Li\n0.750126 0.750126 0.500623 Li\n0.746719 0.746719 0.001254 Li\n0.253281 0.253281 0.998746 Li\n0.249874 0.249874 0.499377 Li\n0.742662 0.250781 0.758606 Li\n0.749219 0.257338 0.241394 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Mn\n0.007794 0.504704 0.240595 Mn\n0.000000 0.000000 0.500000 Mn\n0.495296 0.992206 0.759405 Mn\n0.504704 0.007794 0.240595 Mn\n0.992206 0.495296 0.759405 Mn\n0.500000 0.500000 0.500000 Mn\n0.114122 0.637267 0.012252 O\n0.133217 0.633265 0.505075 O\n0.639508 0.639508 0.744376 O\n0.637217 0.637217 0.248376 O\n0.136899 0.136899 0.247062 O\n0.137345 0.137345 0.742731 O\n0.637267 0.114122 0.012252 O\n0.633265 0.133217 0.505075 O\n0.366735 0.866783 0.494925 O\n0.362733 0.885878 0.987748 O\n0.862655 0.862655 0.257269 O\n0.863101 0.863101 0.752938 O\n0.362783 0.362783 0.751624 O\n0.360492 0.360492 0.255624 O\n0.866783 0.366735 0.494925 O\n0.885878 0.362733 0.987748 O\n",
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{
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"structure_string": "Ni4 Mo32 P12\n1.0\n4.803879 0.000000 0.000000\n2.385310 6.953445 0.000000\n2.244079 0.258489 20.741967\nNi Mo P\n4 32 12\ndirect\n0.441502 0.902998 0.162563 Ni\n0.787148 0.893928 0.494685 Ni\n0.122278 0.893018 0.827908 Ni\n0.843632 0.093580 0.170252 Ni\n0.049172 0.688234 0.164822 Mo\n0.386796 0.683203 0.497959 Mo\n0.720261 0.683609 0.831360 Mo\n0.236891 0.311123 0.168607 Mo\n0.583107 0.308378 0.501908 Mo\n0.913414 0.309409 0.835765 Mo\n0.720537 0.494615 0.105890 Mo\n0.048995 0.496671 0.438071 Mo\n0.384748 0.496033 0.771516 Mo\n0.653920 0.505318 0.227852 Mo\n0.984169 0.504899 0.561732 Mo\n0.314223 0.505797 0.894815 Mo\n0.680816 0.860378 0.280918 Mo\n0.009065 0.859131 0.616117 Mo\n0.339625 0.859141 0.950053 Mo\n0.153675 0.137213 0.053110 Mo\n0.482774 0.143156 0.382452 Mo\n0.815706 0.140777 0.717541 Mo\n0.804484 0.848553 0.048896 Mo\n0.138156 0.852579 0.380495 Mo\n0.471673 0.851945 0.714170 Mo\n0.034555 0.151474 0.284354 Mo\n0.357457 0.154019 0.621971 Mo\n0.689987 0.155117 0.956815 Mo\n0.188626 0.086249 0.504187 Mo\n0.521956 0.085854 0.838603 Mo\n0.253039 0.489740 0.031036 Mo\n0.580820 0.494992 0.366016 Mo\n0.918464 0.494706 0.698557 Mo\n0.109222 0.508642 0.301280 Mo\n0.441261 0.512576 0.633354 Mo\n0.770067 0.514578 0.966815 Mo\n0.227825 0.801683 0.258419 P\n0.555975 0.809264 0.589334 P\n0.885686 0.812091 0.922945 P\n0.620311 0.197022 0.076569 P\n0.946462 0.201845 0.404715 P\n0.277217 0.202043 0.739998 P\n0.334863 0.781567 0.068719 P\n0.666309 0.788255 0.401841 P\n0.000248 0.786153 0.735593 P\n0.520164 0.215468 0.264187 P\n0.840416 0.216425 0.600397 P\n0.172306 0.216553 0.934841 P\n",
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{
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}