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Zn\n0.988997 0.241080 0.395914 Zn\n0.374010 0.741080 0.895914 Zn\n0.011003 0.758920 0.604086 Zn\n0.011003 0.604086 0.758920 Zn\n0.988997 0.395914 0.241080 Zn\n0.497669 0.917556 0.917556 Zn\n0.502331 0.082444 0.082444 Zn\n0.667219 0.417556 0.417556 Zn\n0.332781 0.582444 0.582444 Zn\n0.674488 0.741932 0.741932 Zn\n0.325512 0.258068 0.258068 Zn\n0.841648 0.241932 0.241932 Zn\n0.158352 0.758068 0.758068 Zn\n0.509318 0.670873 0.670873 Zn\n0.490682 0.329127 0.329127 Zn\n0.148937 0.170873 0.170873 Zn\n0.851063 0.829127 0.829127 Zn\n0.555761 0.892739 0.648225 Zn\n0.444239 0.107261 0.351775 Zn\n0.444239 0.351775 0.107261 Zn\n0.903276 0.148225 0.392739 Zn\n0.555761 0.648225 0.892739 Zn\n0.096724 0.851775 0.607261 Zn\n0.096724 0.607261 0.851775 Zn\n0.903276 0.392739 0.148225 Zn\n0.454872 0.848424 0.606210 Zn\n0.545128 0.151576 0.393790 Zn\n0.545128 0.393790 0.151576 Zn\n0.090494 0.106210 0.348424 Zn\n0.454872 0.606210 0.848424 Zn\n0.909506 0.893790 0.651576 Zn\n0.909506 0.651576 0.893790 Zn\n0.090494 0.348424 0.106210 Zn\n0.358436 0.063698 0.922342 Zn\n0.641564 0.936302 0.077658 Zn\n0.641564 0.077658 0.936302 Zn\n0.655525 0.422342 0.563698 Zn\n0.358436 0.922342 0.063698 Zn\n0.344475 0.577658 0.436302 Zn\n0.344475 0.436302 0.577658 Zn\n0.655525 0.563698 0.422342 Zn\n0.102910 0.055957 0.897361 Sn\n0.897090 0.944043 0.102639 Sn\n0.897090 0.102639 0.944043 Sn\n0.943772 0.397361 0.555957 Sn\n0.102910 0.897361 0.055957 Sn\n0.056228 0.602639 0.444043 Sn\n0.056228 0.444043 0.602639 Sn\n0.943772 0.555957 0.397361 Sn\n0.392125 0.954721 0.455151 Sn\n0.607875 0.045279 0.544849 Sn\n0.607875 0.544849 0.045279 Sn\n0.198002 0.955151 0.454721 Sn\n0.392125 0.455151 0.954721 Sn\n0.801998 0.044849 0.545279 Sn\n0.801998 0.545279 0.044849 Sn\n0.198002 0.454721 0.955151 Sn\n0.388436 0.861564 0.361564 Sn\n0.611564 0.138436 0.638436 Sn\n0.611564 0.638436 0.138436 Sn\n0.388436 0.361564 0.861564 Sn\n0.451373 0.673659 0.432857 Sn\n0.548627 0.326341 0.567143 Sn\n0.548627 0.567143 0.326341 Sn\n0.442111 0.932857 0.173659 Sn\n0.451373 0.432857 0.673659 Sn\n0.557889 0.067143 0.826341 Sn\n0.557889 0.826341 0.067143 Sn\n0.442111 0.173659 0.932857 Sn\n0.509963 0.829496 0.829496 Sn\n0.490037 0.170504 0.170504 Sn\n0.831045 0.329496 0.329496 Sn\n0.168955 0.670504 0.670504 Sn\n0.522387 0.582755 0.582755 Sn\n0.477613 0.417245 0.417245 Sn\n0.312103 0.082755 0.082755 Sn\n0.687897 0.917245 0.917245 Sn\n0.336481 0.755896 0.755896 Sn\n0.663519 0.244104 0.244104 Sn\n0.151727 0.255896 0.255896 Sn\n0.848273 0.744104 0.744104 Sn\n0.235479 0.157474 0.815548 Sn\n0.764521 0.842526 0.184452 Sn\n0.764521 0.184452 0.842526 Sn\n0.791499 0.315548 0.657474 Sn\n0.235479 0.815548 0.157474 Sn\n0.208501 0.684452 0.342526 Sn\n0.208501 0.342526 0.684452 Sn\n0.791499 0.657474 0.315548 Sn\n0.232972 0.050036 0.730563 Sn\n0.767028 0.949964 0.269437 Sn\n0.767028 0.269437 0.949964 Sn\n0.986430 0.230563 0.550036 Sn\n0.232972 0.730563 0.050036 Sn\n0.013570 0.769437 0.449964 Sn\n0.013570 0.449964 0.769437 Sn\n0.986430 0.550036 0.230563 Sn\n0.656631 0.752167 0.590136 Sn\n0.343369 0.247833 0.409864 Sn\n0.343369 0.409864 0.247833 Sn\n0.001067 0.090136 0.252167 Sn\n0.656631 0.590136 0.752167 Sn\n0.998933 0.909864 0.747833 Sn\n0.998933 0.747833 0.909864 Sn\n0.001067 0.252167 0.090136 Sn\n","nsites":172,"nelements":3,"elements":["Na","Zn","Sn"],"chemical_system":"Na-Sn-Zn","density":4.526630132273385,"density_atomic":0.03924672736292487,"volume":4382.53101741377,"volume_molar":15.34431318135566,"formula_full":"Na64 Zn44 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0.831142 0.745890 Na\n0.868283 0.831142 0.245890 Na\n0.368283 0.168858 0.254110 Na\n0.127418 0.662167 0.593489 Na\n0.627418 0.337833 0.906511 Na\n0.872582 0.337833 0.406511 Na\n0.372582 0.662167 0.093489 Na\n0.127371 0.342847 0.910435 Na\n0.627371 0.657153 0.589565 Na\n0.872629 0.657153 0.089565 Na\n0.372629 0.342847 0.410435 Na\n0.858240 0.511057 0.894066 Na\n0.358240 0.488943 0.605934 Na\n0.141760 0.488943 0.105934 Na\n0.641760 0.511057 0.394066 Na\n0.899751 0.815228 0.903858 Na\n0.399751 0.184772 0.596142 Na\n0.100249 0.184772 0.096142 Na\n0.600249 0.815228 0.403858 Na\n0.398946 0.824474 0.910106 Na\n0.898946 0.175526 0.589894 Na\n0.601054 0.175526 0.089894 Na\n0.101054 0.824474 0.410106 Na\n0.887913 0.063472 0.882688 H\n0.387913 0.936528 0.617312 H\n0.112087 0.936528 0.117312 H\n0.612087 0.063472 0.382688 H\n0.899837 0.074264 0.972879 H\n0.399837 0.925736 0.527121 H\n0.100163 0.925736 0.027121 H\n0.600163 0.074264 0.472879 H\n0.062539 0.927189 0.722931 H\n0.562539 0.072811 0.777069 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S\n0.615162 0.856839 0.238230 S\n0.379538 0.858879 0.736489 S\n0.879538 0.141121 0.763511 S\n0.620462 0.141121 0.263511 S\n0.120462 0.858879 0.236489 S\n0.353869 0.197067 0.085099 S\n0.853869 0.802933 0.414901 S\n0.646131 0.802933 0.914901 S\n0.146131 0.197067 0.585099 S\n0.852456 0.193534 0.078422 S\n0.352456 0.806466 0.421578 S\n0.147544 0.806466 0.921578 S\n0.647544 0.193534 0.578422 S\n0.878742 0.681984 0.732461 S\n0.378742 0.318016 0.767539 S\n0.121258 0.318016 0.267539 S\n0.621258 0.681984 0.232461 S\n0.376522 0.684015 0.735365 S\n0.876522 0.315985 0.764635 S\n0.623478 0.315985 0.264635 S\n0.123478 0.684015 0.235365 S\n0.383738 0.356016 0.048123 S\n0.883738 0.643984 0.451877 S\n0.616262 0.643984 0.951877 S\n0.116262 0.356016 0.548123 S\n0.886932 0.352011 0.044176 S\n0.386932 0.647989 0.455824 S\n0.113068 0.647989 0.955824 S\n0.613068 0.352011 0.544176 S\n0.759590 0.644387 0.704407 O\n0.259590 0.355613 0.795593 O\n0.240410 0.355613 0.295593 O\n0.740410 0.644387 0.204407 O\n0.899787 0.647758 0.810530 O\n0.399787 0.352242 0.689470 O\n0.100213 0.352242 0.189470 O\n0.600213 0.647758 0.310530 O\n0.970358 0.630033 0.679562 O\n0.470358 0.369967 0.820438 O\n0.029642 0.369967 0.320438 O\n0.529642 0.630033 0.179562 O\n0.387162 0.655856 0.815601 O\n0.887162 0.344144 0.684399 O\n0.612838 0.344144 0.184399 O\n0.112838 0.655856 0.315601 O\n0.266480 0.635989 0.699972 O\n0.766480 0.364011 0.800028 O\n0.733520 0.364011 0.300028 O\n0.233520 0.635989 0.199972 O\n0.480299 0.636760 0.690302 O\n0.980299 0.363240 0.809698 O\n0.519701 0.363240 0.309698 O\n0.019701 0.636760 0.190302 O\n0.304484 0.371109 0.982629 O\n0.804484 0.628891 0.517371 O\n0.695516 0.628891 0.017371 O\n0.195516 0.371109 0.482629 O\n0.508957 0.362164 0.024691 O\n0.008957 0.637836 0.475309 O\n0.491043 0.637836 0.975309 O\n0.991043 0.362164 0.524691 O\n0.357551 0.446412 0.111363 O\n0.857551 0.553588 0.388637 O\n0.642449 0.553588 0.888637 O\n0.142449 0.446412 0.611363 O\n0.859343 0.442988 0.107027 O\n0.359343 0.557012 0.392973 O\n0.140657 0.557012 0.892973 O\n0.640657 0.442988 0.607027 O\n0.014561 0.356512 0.024680 O\n0.514561 0.643488 0.475320 O\n0.985439 0.643488 0.975320 O\n0.485439 0.356512 0.524680 O\n0.812828 0.369795 0.976761 O\n0.312828 0.630205 0.523239 O\n0.187172 0.630205 0.023239 O\n0.687172 0.369795 0.476761 O\n0.918321 0.023027 0.925999 O\n0.418321 0.976973 0.574001 O\n0.081679 0.976973 0.074001 O\n0.581679 0.023027 0.425999 O\n0.130423 0.969651 0.703562 O\n0.630423 0.030349 0.796438 O\n0.869577 0.030349 0.296438 O\n0.369577 0.969651 0.203562 O\n0.135220 0.137564 0.891762 O\n0.635220 0.862436 0.608238 O\n0.864780 0.862436 0.108238 O\n0.364780 0.137564 0.391762 O\n0.352507 0.030968 0.923052 O\n0.852507 0.969032 0.576948 O\n0.647493 0.969032 0.076948 O\n0.147493 0.030968 0.423052 O\n0.137098 0.854862 0.555230 O\n0.637098 0.145138 0.944770 O\n0.862902 0.145138 0.444770 O\n0.362902 0.854862 0.055230 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