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{
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{
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"structure_string": "Li56 Mo8 N32\n1.0\n9.804842 -0.000000 0.000000\n0.000000 9.804842 0.000000\n0.000000 0.000000 9.804842\nLi Mo N\n56 8 32\ndirect\n0.368141 0.631859 0.131859 Li\n0.631859 0.131859 0.368141 Li\n0.131859 0.368141 0.631859 Li\n0.868141 0.868141 0.868141 Li\n0.631859 0.368141 0.868141 Li\n0.368141 0.868141 0.631859 Li\n0.868141 0.631859 0.368141 Li\n0.131859 0.131859 0.131859 Li\n0.369972 0.631380 0.382495 Li\n0.630028 0.131380 0.117505 Li\n0.130028 0.368620 0.882495 Li\n0.869972 0.868620 0.617505 Li\n0.382495 0.369972 0.631380 Li\n0.117505 0.630028 0.131380 Li\n0.882495 0.130028 0.368620 Li\n0.617505 0.869972 0.868620 Li\n0.631380 0.382495 0.369972 Li\n0.131380 0.117505 0.630028 Li\n0.368620 0.882495 0.130028 Li\n0.868620 0.617505 0.869972 Li\n0.630028 0.368620 0.617505 Li\n0.369972 0.868620 0.882495 Li\n0.869972 0.631380 0.117505 Li\n0.130028 0.131380 0.382495 Li\n0.617505 0.630028 0.368620 Li\n0.882495 0.369972 0.868620 Li\n0.117505 0.869972 0.631380 Li\n0.382495 0.130028 0.131380 Li\n0.368620 0.617505 0.630028 Li\n0.868620 0.882495 0.369972 Li\n0.631380 0.117505 0.869972 Li\n0.131380 0.382495 0.130028 Li\n0.401281 0.863184 0.380212 Li\n0.598719 0.363184 0.119788 Li\n0.098719 0.136816 0.880212 Li\n0.901281 0.636816 0.619788 Li\n0.380212 0.401281 0.863184 Li\n0.119788 0.598719 0.363184 Li\n0.880212 0.098719 0.136816 Li\n0.619788 0.901281 0.636816 Li\n0.863184 0.380212 0.401281 Li\n0.363184 0.119788 0.598719 Li\n0.136816 0.880212 0.098719 Li\n0.636816 0.619788 0.901281 Li\n0.598719 0.136816 0.619788 Li\n0.401281 0.636816 0.880212 Li\n0.901281 0.863184 0.119788 Li\n0.098719 0.363184 0.380212 Li\n0.619788 0.598719 0.136816 Li\n0.880212 0.401281 0.636816 Li\n0.119788 0.901281 0.863184 Li\n0.380212 0.098719 0.363184 Li\n0.136816 0.619788 0.598719 Li\n0.636816 0.880212 0.401281 Li\n0.863184 0.119788 0.901281 Li\n0.363184 0.380212 0.098719 Li\n0.130843 0.869157 0.369157 Mo\n0.869157 0.369157 0.130843 Mo\n0.369157 0.130843 0.869157 Mo\n0.630843 0.630843 0.630843 Mo\n0.869157 0.130843 0.630843 Mo\n0.130843 0.630843 0.869157 Mo\n0.630843 0.869157 0.130843 Mo\n0.369157 0.369157 0.369157 Mo\n0.244243 0.755757 0.255757 N\n0.755757 0.255757 0.244243 N\n0.255757 0.244243 0.755757 N\n0.744243 0.744243 0.744243 N\n0.755757 0.244243 0.744243 N\n0.244243 0.744243 0.755757 N\n0.744243 0.755757 0.244243 N\n0.255757 0.255757 0.255757 N\n0.016985 0.988462 0.257207 N\n0.983015 0.488462 0.242793 N\n0.483015 0.011538 0.757207 N\n0.516985 0.511538 0.742793 N\n0.257207 0.016985 0.988462 N\n0.242793 0.983015 0.488462 N\n0.757207 0.483015 0.011538 N\n0.742793 0.516985 0.511538 N\n0.988462 0.257207 0.016985 N\n0.488462 0.242793 0.983015 N\n0.011538 0.757207 0.483015 N\n0.511538 0.742793 0.516985 N\n0.983015 0.011538 0.742793 N\n0.016985 0.511538 0.757207 N\n0.516985 0.988462 0.242793 N\n0.483015 0.488462 0.257207 N\n0.742793 0.983015 0.011538 N\n0.757207 0.016985 0.511538 N\n0.242793 0.516985 0.988462 N\n0.257207 0.483015 0.488462 N\n0.011538 0.742793 0.983015 N\n0.511538 0.757207 0.016985 N\n0.988462 0.242793 0.516985 N\n0.488462 0.257207 0.483015 N\n",
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{
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{
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{
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"structure_string": "Ti20 H2 N17\n1.0\n1.504123 7.810455 0.000000\n-1.504123 7.810455 0.000000\n0.000000 4.622648 16.296889\nTi H N\n20 2 17\ndirect\n0.300203 0.300203 0.923475 Ti\n0.895417 0.895417 0.026329 Ti\n0.499496 0.499496 0.129358 Ti\n0.100530 0.100530 0.221162 Ti\n0.703712 0.703712 0.323886 Ti\n0.496325 0.496325 0.376239 Ti\n0.099136 0.099136 0.476892 Ti\n0.298869 0.298869 0.426657 Ti\n0.701131 0.701131 0.573343 Ti\n0.900864 0.900864 0.523108 Ti\n0.503675 0.503675 0.623761 Ti\n0.296288 0.296288 0.676114 Ti\n0.100036 0.100036 0.726554 Ti\n0.899470 0.899470 0.778838 Ti\n0.500504 0.500504 0.870642 Ti\n0.699592 0.699592 0.825262 Ti\n0.104583 0.104583 0.973671 Ti\n0.699797 0.699797 0.076525 Ti\n0.300408 0.300408 0.174738 Ti\n0.899964 0.899964 0.273446 Ti\n0.100260 0.100260 0.350149 H\n0.899740 0.899740 0.649851 H\n0.099217 0.099217 0.600165 N\n0.700647 0.700647 0.699212 N\n0.300679 0.300679 0.798874 N\n0.900793 0.900793 0.900831 N\n0.099207 0.099207 0.099169 N\n0.699321 0.699321 0.201126 N\n0.901038 0.901038 0.148622 N\n0.299353 0.299353 0.300788 N\n0.500072 0.500072 0.250927 N\n0.900783 0.900783 0.399835 N\n0.699762 0.699762 0.449585 N\n0.300238 0.300238 0.550415 N\n0.500000 0.500000 0.500000 N\n0.499928 0.499928 0.749073 N\n0.098962 0.098962 0.851378 N\n0.698184 0.698184 0.951048 N\n0.301816 0.301816 0.048952 N\n",
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{
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"structure_string": "Li8 Mn4 O8 F4\n1.0\n4.889858 0.000000 0.000000\n0.000000 5.626952 0.000000\n0.000000 0.000000 8.563318\nLi Mn O F\n8 4 8 4\ndirect\n0.701943 0.127504 0.422893 Li\n0.701943 0.127504 0.077107 Li\n0.201943 0.372496 0.577107 Li\n0.201943 0.372496 0.922893 Li\n0.798057 0.627504 0.077107 Li\n0.798057 0.627504 0.422893 Li\n0.298057 0.872496 0.577107 Li\n0.298057 0.872496 0.922893 Li\n0.745839 0.126385 0.750000 Mn\n0.245839 0.373615 0.250000 Mn\n0.754161 0.626385 0.750000 Mn\n0.254161 0.873615 0.250000 Mn\n0.277124 0.124329 0.096192 O\n0.277124 0.124329 0.403808 O\n0.777124 0.375671 0.903808 O\n0.777124 0.375671 0.596192 O\n0.222876 0.624329 0.096192 O\n0.222876 0.624329 0.403808 O\n0.722876 0.875671 0.596192 O\n0.722876 0.875671 0.903808 O\n0.262616 0.134112 0.750000 F\n0.762616 0.365888 0.250000 F\n0.237384 0.634112 0.750000 F\n0.737384 0.865888 0.250000 F\n",
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{
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"structure_string": "Cr8 B8 Ir4\n1.0\n1.444884 -5.046867 0.000000\n1.444884 5.046867 0.000000\n0.000000 0.000000 13.462898\nCr B Ir\n8 8 4\ndirect\n0.825283 0.174717 0.941508 Cr\n0.001618 0.998382 0.750000 Cr\n0.998382 0.001618 0.250000 Cr\n0.268764 0.731236 0.250000 Cr\n0.731236 0.268764 0.750000 Cr\n0.174717 0.825283 0.058492 Cr\n0.174717 0.825283 0.441508 Cr\n0.825283 0.174717 0.558492 Cr\n0.798131 0.201869 0.369720 B\n0.798131 0.201869 0.130280 B\n0.201869 0.798131 0.630280 B\n0.635175 0.364825 0.318327 B\n0.364825 0.635175 0.681673 B\n0.635175 0.364825 0.181673 B\n0.201869 0.798131 0.869720 B\n0.364825 0.635175 0.818327 B\n0.443854 0.556146 0.411004 Ir\n0.443854 0.556146 0.088996 Ir\n0.556146 0.443854 0.911004 Ir\n0.556146 0.443854 0.588996 Ir\n",
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{
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