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"structure_string": "Zn2 Co2 O6\n1.0\n4.382201 -0.009063 3.105930\n1.600701 4.079402 3.105930\n-0.013321 -0.009063 5.371247\nZn Co O\n2 2 6\ndirect\n0.368438 0.368439 0.368438 Zn\n0.631561 0.631562 0.631562 Zn\n0.160761 0.160762 0.160762 Co\n0.839238 0.839239 0.839239 Co\n0.437412 0.787811 0.044829 O\n0.787811 0.044829 0.437412 O\n0.044828 0.437413 0.787811 O\n0.955171 0.562588 0.212189 O\n0.212189 0.955172 0.562588 O\n0.562587 0.212190 0.955172 O\n",
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{
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{
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"structure_string": "Ce2 Pr2 O4\n1.0\n-2.518750 2.518750 5.021631\n2.518750 -2.518750 5.021631\n2.518750 2.518750 -5.021631\nCe Pr O\n2 2 4\ndirect\n0.500000 0.500000 0.000000 Ce\n0.250000 0.750000 0.500000 Ce\n0.000000 0.000000 0.000000 Pr\n0.750000 0.250000 0.500000 Pr\n0.254049 0.254049 0.000000 O\n0.495951 0.995951 0.500000 O\n0.745951 0.745951 0.000000 O\n0.004049 0.504049 0.500000 O\n",
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{
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"structure_string": "H8 N4 O6\n1.0\n5.631960 0.000000 0.000000\n0.000000 5.631960 -0.000000\n0.000000 -0.000000 4.796700\nH N O\n8 4 6\ndirect\n0.527958 0.647698 0.374278 H\n0.972042 0.147698 0.625722 H\n0.472042 0.352302 0.374278 H\n0.027958 0.852302 0.625722 H\n0.647698 0.472042 0.625722 H\n0.852302 0.972042 0.374278 H\n0.352302 0.527958 0.625722 H\n0.147698 0.027958 0.374278 H\n0.500000 0.000000 0.963240 N\n0.000000 0.500000 0.036760 N\n0.500000 0.500000 0.500000 N\n0.000000 0.000000 0.500000 N\n0.638642 0.861358 0.095488 O\n0.000000 0.500000 0.298311 O\n0.500000 0.000000 0.701689 O\n0.361358 0.138642 0.095488 O\n0.138642 0.638642 0.904512 O\n0.861358 0.361358 0.904512 O\n",
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"structure_string": "K1 Ba1 Hg2\n1.0\n-14.379136 1.121874 1.348663\n-11.579171 0.957434 4.481646\n-9.362480 3.671412 2.642225\nK Ba Hg\n1 1 2\ndirect\n0.000001 -0.000001 0.999999 K\n0.500001 1.000001 0.999997 Ba\n0.753419 0.007865 0.977605 Hg\n0.246583 0.992136 0.022392 Hg\n",
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"structure_string": "Li2 Mg2 H6\n1.0\n4.376527 0.005891 2.971482\n1.577239 4.082443 2.971482\n0.008578 0.005891 5.289955\nLi Mg H\n2 2 6\ndirect\n0.288457 0.288456 0.288457 Li\n0.788458 0.788456 0.788457 Li\n0.997846 0.997843 0.997844 Mg\n0.497845 0.497843 0.497844 Mg\n0.099696 0.703773 0.390030 H\n0.703775 0.390029 0.099695 H\n0.390030 0.099695 0.703774 H\n0.890031 0.203773 0.599695 H\n0.599696 0.890029 0.203774 H\n0.203775 0.599694 0.890030 H\n",
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{
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"structure_string": "La4 Co4 I2\n1.0\n4.038111 0.000000 0.000000\n-2.019056 3.497107 0.000000\n-0.000000 -0.000000 17.924223\nLa Co I\n4 4 2\ndirect\n0.000000 0.000000 0.104647 La\n0.000000 0.000000 0.895353 La\n0.000000 0.000000 0.604647 La\n0.000000 0.000000 0.395353 La\n0.333333 0.666667 0.499710 Co\n0.666666 0.333334 0.500290 Co\n0.666666 0.333334 0.999710 Co\n0.333333 0.666667 0.000290 Co\n0.333333 0.666667 0.250000 I\n0.666666 0.333334 0.750000 I\n",
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"structure_string": "H6 C10 S3\n1.0\n3.900310 0.029742 -0.002253\n-1.182608 6.111640 -0.004046\n0.004987 0.008102 9.683660\nH C S\n6 10 3\ndirect\n0.649347 0.709462 0.077880 H\n0.767603 0.146737 0.231694 H\n0.049618 0.190079 0.681289 H\n0.048746 0.190096 0.474689 H\n0.768425 0.146720 0.924284 H\n0.444699 0.433831 0.077880 H\n0.252148 0.650209 0.577903 C\n0.701996 0.541797 0.077896 C\n0.140216 0.545487 0.708021 C\n0.879848 0.502092 0.210972 C\n0.879949 0.502097 0.944851 C\n0.027730 0.328794 0.746229 C\n0.882709 0.304385 0.275947 C\n0.883212 0.304385 0.879962 C\n0.027222 0.328802 0.409681 C\n0.140106 0.545485 0.447807 C\n0.071698 0.718282 0.843757 S\n0.071941 0.718266 0.311995 S\n0.457264 0.911540 0.577889 S\n",
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