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{
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{
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"structure_string": "Cs4 H4 C4 O12\n1.0\n-4.548049 0.000000 1.480989\n0.412765 0.000000 -8.395401\n0.000000 -11.265240 0.000000\nCs H C O\n4 4 4 12\ndirect\n0.653705 0.085175 0.824211 Cs\n0.153705 0.585175 0.675789 Cs\n0.346295 0.914825 0.175789 Cs\n0.846295 0.414825 0.324211 Cs\n0.500254 0.497064 0.902663 H\n0.000254 0.997064 0.597337 H\n0.499746 0.502936 0.097337 H\n0.999746 0.002936 0.402663 H\n0.862131 0.690849 0.952430 C\n0.362131 0.190849 0.547570 C\n0.137869 0.309151 0.047570 C\n0.637869 0.809151 0.452430 C\n0.095874 0.808004 0.917085 O\n0.595874 0.308004 0.582915 O\n0.904126 0.191996 0.082915 O\n0.404126 0.691996 0.417085 O\n0.782889 0.656254 0.061065 O\n0.282889 0.156254 0.438935 O\n0.217111 0.343746 0.938935 O\n0.717111 0.843746 0.561065 O\n0.678091 0.593247 0.865715 O\n0.178091 0.093247 0.634285 O\n0.321909 0.406753 0.134285 O\n0.821909 0.906753 0.365715 O\n",
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},
{
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"structure_string": "Ba4 Co4 N8\n1.0\n6.425446 -0.057701 0.000000\n10.289618 5.076290 0.000000\n0.000000 0.000000 7.692186\nBa Co N\n4 4 8\ndirect\n0.000000 0.158707 0.559754 Ba\n0.000000 0.841293 0.440246 Ba\n0.000000 0.341293 0.059754 Ba\n0.000000 0.658707 0.940246 Ba\n0.000000 0.446938 0.634100 Co\n0.000000 0.553062 0.365900 Co\n0.000000 0.053062 0.134100 Co\n0.000000 0.946938 0.865900 Co\n0.000000 0.110767 0.912052 N\n0.000000 0.889233 0.087948 N\n0.000000 0.389233 0.412052 N\n0.000000 0.610767 0.587948 N\n0.500000 0.654385 0.750000 N\n0.500000 0.845615 0.250000 N\n0.500000 0.345615 0.250000 N\n0.500000 0.154385 0.750000 N\n",
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{
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"structure_string": "Sr1 Cu1 O3\n1.0\n3.884508 0.000000 0.000000\n0.000000 3.884508 0.000000\n0.000000 0.000000 3.884508\nSr Cu O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.000000 0.500000 O\n",
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{
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"structure_string": "Sb1\n1.0\n-1.892661 1.892661 1.892661\n1.892661 -1.892661 1.892661\n1.892661 1.892661 -1.892661\nSb\n1\ndirect\n0.000000 0.000000 0.000000 Sb\n",
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"spacegroup": 229
},
{
"id": "mp-2697",
"created_at": "2022-09-04T14:45:25.948725Z",
"structure_string": "Sr1 O2\n1.0\n-1.786652 1.786652 3.410290\n1.786652 -1.786652 3.410290\n1.786652 1.786652 -3.410290\nSr O\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.389346 0.389346 0.000000 O\n0.610654 0.610654 0.000000 O\n",
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},
{
"id": "mp-542724",
"created_at": "2022-09-04T14:45:25.972435Z",
"structure_string": "La2 Nb2 O8\n1.0\n5.850338 3.785675 0.000000\n-5.850338 3.785675 0.000000\n0.000000 3.673856 3.903858\nLa Nb O\n2 2 8\ndirect\n0.126715 0.873285 0.250000 La\n0.873285 0.126715 0.750000 La\n0.615113 0.384887 0.250000 Nb\n0.384887 0.615113 0.750000 Nb\n0.137077 0.553121 0.662182 O\n0.446879 0.862923 0.837818 O\n0.862923 0.446879 0.337818 O\n0.553121 0.137077 0.162182 O\n0.779972 0.708413 0.827605 O\n0.291587 0.220028 0.672395 O\n0.220028 0.291587 0.172395 O\n0.708413 0.779972 0.327605 O\n",
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{
"id": "mp-1195436",
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"structure_string": "Cd12 B4 P4 O28\n1.0\n5.169412 0.000000 0.000000\n0.000000 8.980562 0.000000\n0.000000 0.000000 13.494923\nCd B P O\n12 4 4 28\ndirect\n0.998212 0.903606 0.136609 Cd\n0.498212 0.096394 0.863391 Cd\n0.498212 0.403606 0.363391 Cd\n0.998212 0.596394 0.636609 Cd\n0.014220 0.910682 0.402408 Cd\n0.514220 0.089318 0.597592 Cd\n0.514220 0.410682 0.097592 Cd\n0.014220 0.589318 0.902408 Cd\n0.000380 0.238590 0.246748 Cd\n0.500380 0.761410 0.753252 Cd\n0.500380 0.738590 0.253252 Cd\n0.000380 0.261410 0.746748 Cd\n0.998609 0.569306 0.226903 B\n0.498609 0.430694 0.773097 B\n0.498609 0.069306 0.273097 B\n0.998609 0.930694 0.726903 B\n0.022808 0.229480 0.996277 P\n0.522808 0.770520 0.003723 P\n0.522808 0.729480 0.503723 P\n0.022808 0.270520 0.496277 P\n0.324614 0.244778 0.990623 O\n0.824614 0.755222 0.009377 O\n0.824614 0.744778 0.509377 O\n0.324614 0.255222 0.490623 O\n0.940153 0.139564 0.089570 O\n0.440153 0.860436 0.910430 O\n0.440153 0.639564 0.410430 O\n0.940153 0.360436 0.589570 O\n0.897254 0.386743 0.003802 O\n0.397254 0.613257 0.996198 O\n0.397254 0.886743 0.496198 O\n0.897254 0.113257 0.503802 O\n0.433955 0.855494 0.098096 O\n0.933955 0.144506 0.901904 O\n0.933955 0.355494 0.401904 O\n0.433955 0.644506 0.598096 O\n0.063470 0.716598 0.247002 O\n0.563470 0.283402 0.752998 O\n0.563470 0.216598 0.252998 O\n0.063470 0.783402 0.747002 O\n0.189325 0.460413 0.218018 O\n0.689325 0.539587 0.781982 O\n0.689325 0.960413 0.281982 O\n0.189325 0.039587 0.718018 O\n0.236781 0.032827 0.280402 O\n0.736781 0.967173 0.719598 O\n0.736781 0.532827 0.219598 O\n0.236781 0.467173 0.780402 O\n",
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{
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"structure_string": "Na8 B8 H64 O16\n1.0\n6.893439 0.000000 0.000000\n0.000000 10.320366 0.000000\n0.000000 0.000000 12.067555\nNa B H O\n8 8 64 16\ndirect\n0.952589 0.829331 0.987853 Na\n0.452589 0.170669 0.512147 Na\n0.547411 0.329331 0.012147 Na\n0.047411 0.670669 0.487853 Na\n0.047411 0.170669 0.012147 Na\n0.547411 0.829331 0.487853 Na\n0.452589 0.670669 0.987853 Na\n0.952589 0.329331 0.512147 Na\n0.097715 0.612300 0.850077 B\n0.597715 0.387700 0.649923 B\n0.402285 0.112300 0.149923 B\n0.902285 0.887700 0.350077 B\n0.902285 0.387700 0.149923 B\n0.402285 0.612300 0.350077 B\n0.597715 0.887700 0.850077 B\n0.097715 0.112300 0.649923 B\n0.268941 0.610000 0.822707 H\n0.768941 0.390000 0.677293 H\n0.231059 0.110000 0.177293 H\n0.731059 0.890000 0.322707 H\n0.731059 0.390000 0.177293 H\n0.231059 0.610000 0.322707 H\n0.768941 0.890000 0.822707 H\n0.268941 0.110000 0.677293 H\n0.018837 0.511500 0.816684 H\n0.518837 0.488500 0.683316 H\n0.481163 0.011500 0.183316 H\n0.981163 0.988500 0.316684 H\n0.981163 0.488500 0.183316 H\n0.481163 0.511500 0.316684 H\n0.518837 0.988500 0.816684 H\n0.018837 0.011500 0.683316 H\n0.894031 0.490213 0.318548 H\n0.394031 0.509787 0.181452 H\n0.605969 0.990213 0.681452 H\n0.105969 0.009787 0.818548 H\n0.105969 0.509787 0.681452 H\n0.605969 0.490213 0.818548 H\n0.394031 0.009787 0.318548 H\n0.894031 0.990213 0.181452 H\n0.016511 0.205102 0.692603 H\n0.212601 0.475304 0.111864 H\n0.787399 0.024696 0.611864 H\n0.287399 0.975304 0.888136 H\n0.287399 0.475304 0.611864 H\n0.787399 0.524696 0.888136 H\n0.212601 0.975304 0.388136 H\n0.712601 0.024696 0.111864 H\n0.016511 0.705102 0.807397 H\n0.516511 0.294898 0.692603 H\n0.483489 0.205102 0.192603 H\n0.983489 0.794898 0.307397 H\n0.983489 0.294898 0.192603 H\n0.483489 0.705102 0.307397 H\n0.516511 0.794898 0.807397 H\n0.082514 0.114379 0.548774 H\n0.233181 0.267153 0.322418 H\n0.733181 0.732847 0.177582 H\n0.266819 0.767153 0.677582 H\n0.766819 0.232847 0.822418 H\n0.766819 0.732847 0.677582 H\n0.266819 0.267153 0.822418 H\n0.733181 0.232847 0.322418 H\n0.233181 0.767153 0.177582 H\n0.306477 0.394277 0.376339 H\n0.806477 0.605723 0.123661 H\n0.193523 0.894277 0.623661 H\n0.693523 0.105723 0.876339 H\n0.693523 0.605723 0.623661 H\n0.193523 0.394277 0.876339 H\n0.806477 0.105723 0.376339 H\n0.306477 0.894277 0.123661 H\n0.082514 0.614379 0.951226 H\n0.582514 0.385621 0.548774 H\n0.417486 0.114379 0.048774 H\n0.917486 0.885621 0.451226 H\n0.917486 0.385621 0.048774 H\n0.417486 0.614379 0.451226 H\n0.582514 0.885621 0.951226 H\n0.712601 0.524696 0.388136 H\n0.249356 0.809458 0.105581 O\n0.749356 0.190542 0.394419 O\n0.250644 0.309458 0.894419 O\n0.750644 0.690542 0.605581 O\n0.750644 0.190542 0.894419 O\n0.250644 0.809458 0.605581 O\n0.749356 0.690542 0.105581 O\n0.249356 0.309458 0.394419 O\n0.852805 0.009207 0.104957 O\n0.352805 0.990793 0.395043 O\n0.647195 0.509207 0.895043 O\n0.147195 0.490793 0.604957 O\n0.147195 0.990793 0.895043 O\n0.647195 0.009207 0.604957 O\n0.352805 0.490793 0.104957 O\n0.852805 0.509207 0.395043 O\n",
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}