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{
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"structure_string": "Li6 V2 O2 F10\n1.0\n5.053421 -0.124686 -0.223730\n-1.726938 5.341254 0.396744\n-0.151829 0.353622 8.079555\nLi V O F\n6 2 2 10\ndirect\n0.059079 0.919020 0.652684 Li\n0.559082 0.419017 0.152687 Li\n-0.010258 0.389059 0.688208 Li\n0.489748 0.889060 0.188208 Li\n0.484986 0.745627 0.826939 Li\n-0.015013 0.245631 0.326939 Li\n0.522822 0.567041 0.499619 V\n0.022820 0.067037 -0.000381 V\n0.217409 0.072324 0.172574 O\n0.717400 0.572322 0.672575 O\n0.707380 0.751150 0.041950 F\n0.802413 0.054285 0.773581 F\n0.302414 0.554286 0.273579 F\n0.771066 0.214631 0.090579 F\n0.271055 0.714634 0.590577 F\n0.220921 0.905740 0.877110 F\n0.720922 0.405738 0.377112 F\n0.729785 0.896321 0.392547 F\n0.229785 0.396327 0.892545 F\n0.207378 0.251155 0.541951 F\n",
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{
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"structure_string": "H1 C1 N1 O1\n1.0\n3.295876 0.000000 -0.877171\n0.000000 2.410179 0.000000\n-0.155816 0.000000 4.076745\nH C N O\n1 1 1 1\ndirect\n0.195733 0.000000 0.166954 H\n0.579067 0.500000 0.564964 C\n0.421213 0.000000 0.400488 N\n0.848047 0.500000 0.841633 O\n",
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{
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"structure_string": "Mg4 B4 As2 Ir10\n1.0\n9.487380 -0.000000 0.000000\n-0.000000 9.487380 -0.000000\n0.000000 -0.000000 2.991542\nMg B As Ir\n4 4 2 10\ndirect\n0.825117 0.325117 0.000000 Mg\n0.174883 0.674883 0.000000 Mg\n0.325117 0.174883 0.000000 Mg\n0.674883 0.825117 0.000000 Mg\n0.625219 0.125219 0.000000 B\n0.374781 0.874781 0.000000 B\n0.125219 0.374781 0.000000 B\n0.874781 0.625219 0.000000 B\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.000000 As\n0.073378 0.215830 0.500000 Ir\n0.500000 0.000000 0.500000 Ir\n0.000000 0.500000 0.500000 Ir\n0.715830 0.573378 0.500000 Ir\n0.284170 0.426622 0.500000 Ir\n0.215830 0.926622 0.500000 Ir\n0.784170 0.073378 0.500000 Ir\n0.426622 0.715830 0.500000 Ir\n0.573378 0.284170 0.500000 Ir\n0.926622 0.784170 0.500000 Ir\n",
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{
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"structure_string": "Ba2 Y1 Cu3 O6\n1.0\n3.878143 0.000000 0.000000\n-0.000000 3.878143 0.000000\n-0.000000 -0.000000 12.074846\nBa Y Cu O\n2 1 3 6\ndirect\n0.500000 0.500000 0.197430 Ba\n0.500000 0.500000 0.802570 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.368210 Cu\n0.000000 0.000000 0.631790 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.619134 O\n0.000000 0.500000 0.380866 O\n0.000000 0.500000 0.619134 O\n0.000000 0.000000 0.149935 O\n0.500000 0.000000 0.380866 O\n0.000000 0.000000 0.850066 O\n",
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{
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"structure_string": "Ba3 In2 Mo1 O9\n1.0\n5.932418 -0.000000 0.000000\n-2.966209 5.137625 0.000000\n-0.000000 -0.000000 7.257039\nBa In Mo O\n3 2 1 9\ndirect\n0.000000 0.000000 0.500000 Ba\n0.666667 0.333334 0.815316 Ba\n0.333334 0.666667 0.184685 Ba\n0.666667 0.333334 0.332309 In\n0.333334 0.666667 0.667691 In\n0.000000 0.000000 0.000000 Mo\n0.689751 0.844876 0.848120 O\n0.310250 0.155125 0.151881 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.155124 0.310250 0.848120 O\n0.844876 0.689751 0.151881 O\n0.500000 0.500000 0.500000 O\n0.155125 0.844876 0.848120 O\n0.844876 0.155125 0.151881 O\n",
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{
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"structure_string": "Cd1 H14 C9 O4\n1.0\n4.019901 0.110565 0.402712\n0.895008 4.249393 0.273169\n-0.085899 0.083105 13.094470\nCd H C O\n1 14 9 4\ndirect\n0.960363 0.093518 0.813894 Cd\n0.548927 0.171730 0.451171 H\n0.224701 0.769371 0.169128 H\n0.661677 0.718288 0.126766 H\n0.403143 0.715105 0.362869 H\n0.832440 0.666244 0.313927 H\n0.970108 0.116009 0.395295 H\n0.030929 0.591384 0.489706 H\n0.207748 0.271967 0.084499 H\n0.645560 0.206396 0.046651 H\n0.358022 0.243746 0.268261 H\n0.790333 0.186311 0.222931 H\n0.403944 0.819866 0.547618 H\n0.402274 0.461027 0.619053 H\n0.011441 0.244826 0.565270 H\n0.325087 0.570972 0.961015 C\n0.415006 0.394601 0.062229 C\n0.461366 0.589461 0.150586 C\n0.560537 0.371320 0.245060 C\n0.859995 0.437161 0.518287 C\n0.750461 0.297731 0.425972 C\n0.565220 0.619682 0.588556 C\n0.675341 0.743007 0.681683 C\n0.632968 0.535628 0.337405 C\n0.110337 0.841502 0.963044 O\n0.936344 0.588205 0.725935 O\n0.510644 0.013307 0.714537 O\n0.450052 0.438584 0.877841 O\n",
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"structure_string": "Li3 Nb1 V4 O8\n1.0\n5.045924 0.025714 2.870372\n1.657410 4.766026 2.870372\n-0.081457 -0.058228 5.988878\nLi Nb V O\n3 1 4 8\ndirect\n-0.000000 0.500000 0.500000 Li\n0.499999 -0.000001 0.500001 Li\n-0.000000 -0.000000 0.500000 Li\n0.500000 0.500000 -0.000000 Nb\n0.000000 0.000000 0.000000 V\n0.500000 -0.000000 0.000000 V\n-0.000000 0.500000 -0.000000 V\n0.499999 0.500000 0.500000 V\n0.245387 0.245387 0.251493 O\n0.755582 0.239860 0.260670 O\n0.239860 0.755583 0.260670 O\n0.754612 0.754613 0.748507 O\n0.751317 0.751318 0.244370 O\n0.244417 0.760140 0.739330 O\n0.760139 0.244417 0.739330 O\n0.248681 0.248682 0.755630 O\n",
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"structure_string": "Li2 Ti1 V3 O8\n1.0\n5.102189 0.051601 2.962165\n1.729826 4.800281 2.962165\n0.072660 0.051601 5.899277\nLi Ti V O\n2 1 3 8\ndirect\n0.874148 0.874146 0.874145 Li\n0.125854 0.125853 0.125853 Li\n0.500001 0.500000 0.499999 Ti\n0.000000 0.500000 0.500000 V\n0.500000 -0.000000 0.500000 V\n0.500001 0.500000 -0.000001 V\n0.739176 0.739175 0.739174 O\n0.739258 0.739257 0.280993 O\n0.739258 0.280994 0.739257 O\n0.280995 0.739257 0.739257 O\n0.719006 0.260742 0.260742 O\n0.260743 0.719005 0.260741 O\n0.260743 0.260742 0.719005 O\n0.260825 0.260825 0.260824 O\n",
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