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{
"id": "mp-1224699",
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{
"id": "mp-1048399",
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"structure_string": "Ca4 Ni4 P8 O28\n1.0\n8.763141 0.000000 0.000000\n0.000000 7.298029 0.000000\n0.000000 4.091439 8.161186\nCa Ni P O\n4 4 8 28\ndirect\n0.954245 0.728923 0.118626 Ca\n0.454245 0.271077 0.381374 Ca\n0.545755 0.728923 0.618626 Ca\n0.045755 0.271077 0.881374 Ca\n0.075285 0.224173 0.385252 Ni\n0.924715 0.775827 0.614748 Ni\n0.575285 0.775827 0.114748 Ni\n0.424715 0.224173 0.885252 Ni\n0.722868 0.048311 0.763989 P\n0.249883 0.523649 0.036352 P\n0.777132 0.048311 0.263989 P\n0.250117 0.523649 0.536352 P\n0.222868 0.951689 0.736011 P\n0.749883 0.476351 0.463648 P\n0.750117 0.476351 0.963648 P\n0.277132 0.951689 0.236011 P\n0.182992 0.738502 0.895476 O\n0.632178 0.064404 0.348608 O\n0.867822 0.064404 0.848608 O\n0.394028 0.561177 0.112157 O\n0.817008 0.261498 0.104524 O\n0.078857 0.985214 0.627955 O\n0.605972 0.438823 0.887843 O\n0.108453 0.458366 0.149810 O\n0.230175 0.383645 0.453704 O\n0.921143 0.014786 0.372045 O\n0.421143 0.985214 0.127955 O\n0.766462 0.893831 0.193482 O\n0.266462 0.106169 0.306518 O\n0.317008 0.738502 0.395476 O\n0.578857 0.014786 0.872045 O\n0.132178 0.935596 0.151392 O\n0.233538 0.106169 0.806518 O\n0.891547 0.541634 0.850190 O\n0.269825 0.383645 0.953704 O\n0.730175 0.616355 0.046296 O\n0.894028 0.438823 0.387843 O\n0.391547 0.458366 0.649810 O\n0.608453 0.541634 0.350190 O\n0.367822 0.935596 0.651392 O\n0.733538 0.893831 0.693482 O\n0.105972 0.561177 0.612157 O\n0.769825 0.616355 0.546296 O\n0.682992 0.261498 0.604524 O\n",
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"formula_full": "Ca4 Ni4 P8 O28",
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{
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"structure_string": "Na2 U1 F6\n1.0\n3.038165 -5.262256 0.000000\n3.038165 5.262256 0.000000\n0.000000 0.000000 3.734681\nNa U F\n2 1 6\ndirect\n0.333333 0.666667 0.420575 Na\n0.666667 0.333333 0.579425 Na\n0.000000 0.000000 0.000000 U\n0.751413 0.751413 0.500000 F\n0.000000 0.248587 0.500000 F\n0.248587 0.000000 0.500000 F\n0.629296 0.000000 0.000000 F\n0.000000 0.629296 0.000000 F\n0.370704 0.370704 0.000000 F\n",
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{
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{
"id": "mp-1197645",
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"structure_string": "Si4 B2 P2 H58 C18 N2\n1.0\n5.411542 -7.671492 0.000000\n5.411542 7.671492 0.000000\n0.000000 0.000000 11.598027\nSi B P H C N\n4 2 2 58 18 2\ndirect\n0.215509 0.978211 0.838728 Si\n0.978211 0.215509 0.838728 Si\n0.784491 0.021789 0.338728 Si\n0.021789 0.784491 0.338728 Si\n0.347478 0.347478 0.916704 B\n0.652522 0.652522 0.416704 B\n0.162914 0.162914 0.936960 P\n0.837086 0.837086 0.436960 P\n0.379585 0.827761 0.884512 H\n0.827761 0.379585 0.884512 H\n0.620415 0.172239 0.384512 H\n0.172239 0.620415 0.384512 H\n0.300036 0.873114 0.013523 H\n0.873114 0.300036 0.013523 H\n0.699964 0.126886 0.513523 H\n0.126886 0.699964 0.513523 H\n0.457150 0.011161 0.946265 H\n0.011161 0.457150 0.946265 H\n0.542850 0.988839 0.446265 H\n0.988839 0.542850 0.446265 H\n0.968335 0.824214 0.750506 H\n0.824214 0.968335 0.750506 H\n0.031665 0.175786 0.250506 H\n0.175786 0.031665 0.250506 H\n0.979249 0.767058 0.896454 H\n0.767058 0.979249 0.896454 H\n0.020751 0.232942 0.396454 H\n0.232942 0.020751 0.396454 H\n0.081716 0.712312 0.785634 H\n0.712312 0.081716 0.785634 H\n0.918284 0.287688 0.285634 H\n0.287688 0.918284 0.285634 H\n0.333067 0.936182 0.654053 H\n0.936182 0.333067 0.654053 H\n0.666933 0.063818 0.154053 H\n0.063818 0.666933 0.154053 H\n0.407916 0.129215 0.696690 H\n0.129215 0.407916 0.696690 H\n0.592084 0.870785 0.196690 H\n0.870785 0.592084 0.196690 H\n0.224527 0.056804 0.632680 H\n0.056804 0.224527 0.632680 H\n0.775473 0.943196 0.132680 H\n0.943196 0.775473 0.132680 H\n0.523111 0.639930 0.965825 H\n0.639930 0.523111 0.965825 H\n0.476889 0.360070 0.465825 H\n0.360070 0.476889 0.465825 H\n0.609486 0.609486 0.097406 H\n0.390514 0.390514 0.597406 H\n0.216567 0.379229 0.132180 H\n0.379229 0.216567 0.132180 H\n0.783433 0.620771 0.632180 H\n0.620771 0.783433 0.632180 H\n0.286551 0.559778 0.062089 H\n0.559778 0.286551 0.062089 H\n0.713449 0.440222 0.562089 H\n0.440222 0.713449 0.562089 H\n0.376061 0.527113 0.191419 H\n0.527113 0.376061 0.191419 H\n0.623939 0.472887 0.691419 H\n0.472887 0.623939 0.691419 H\n0.449433 0.316611 0.869261 H\n0.316611 0.449433 0.869261 H\n0.550567 0.683389 0.369261 H\n0.683389 0.550567 0.369261 H\n0.351392 0.917742 0.930125 C\n0.917742 0.351392 0.930125 C\n0.648608 0.082258 0.430125 C\n0.082258 0.648608 0.430125 C\n0.043510 0.804581 0.816509 C\n0.804581 0.043510 0.816509 C\n0.956490 0.195419 0.316509 C\n0.195419 0.956490 0.316509 C\n0.303957 0.030757 0.691668 C\n0.030757 0.303957 0.691668 C\n0.696043 0.969243 0.191668 C\n0.969243 0.696043 0.191668 C\n0.558358 0.558358 0.015535 C\n0.441642 0.441642 0.515535 C\n0.317805 0.475746 0.111513 C\n0.475746 0.317805 0.111513 C\n0.682195 0.524254 0.611513 C\n0.524254 0.682195 0.611513 C\n0.423014 0.423014 0.040854 N\n0.576986 0.576986 0.540854 N\n",
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{
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"structure_string": "Lu1 Au2\n1.0\n-1.841401 1.841401 4.508882\n1.841401 -1.841401 4.508882\n1.841401 1.841401 -4.508882\nLu Au\n1 2\ndirect\n0.000000 0.000000 0.000000 Lu\n0.663303 0.663303 0.000000 Au\n0.336697 0.336697 0.000000 Au\n",
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{
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{
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