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{
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{
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{
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"structure_string": "H14 C14 N2 O2\n1.0\n5.557077 -0.108467 2.119754\n2.327089 6.387731 0.820185\n-0.162061 -0.066819 7.606500\nH C N O\n14 14 2 2\ndirect\n0.475300 0.720920 0.872009 H\n0.891053 0.077535 0.123637 H\n0.391052 0.577537 0.623638 H\n0.921760 0.679561 0.702826 H\n0.835117 0.537440 0.457522 H\n0.335117 0.037440 0.957521 H\n0.933245 0.287337 0.804321 H\n0.421760 0.179560 0.202825 H\n0.414562 0.048699 0.591997 H\n0.914562 0.548697 0.091999 H\n0.348132 0.299907 0.491388 H\n0.848133 0.799904 0.991388 H\n0.975300 0.220920 0.372008 H\n0.433246 0.787335 0.304323 H\n0.355131 0.298420 0.771294 C\n0.895983 0.989848 0.251183 C\n0.395983 0.489849 0.751184 C\n0.944920 0.071666 0.389685 C\n0.444919 0.571666 0.889686 C\n0.855132 0.798420 0.271295 C\n0.954849 0.958486 0.552057 C\n0.300271 0.213605 0.621094 C\n0.864121 0.688107 0.436440 C\n0.364121 0.188108 0.936440 C\n0.913147 0.766363 0.575770 C\n0.413146 0.266362 0.075769 C\n0.800271 0.713603 0.121094 C\n0.454849 0.458486 0.052057 C\n0.528893 0.729343 0.170958 N\n0.028892 0.229344 0.670957 N\n0.509347 0.519060 0.196414 O\n0.009346 0.019062 0.696414 O\n",
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{
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"structure_string": "La1 Mn1 Fe1 Ge2\n1.0\n3.863569 0.007034 -4.704889\n-0.489711 3.832414 -4.704889\n-0.006181 -0.007034 6.087948\nLa Mn Fe Ge\n1 1 1 2\ndirect\n0.000000 0.000000 0.000000 La\n0.250000 0.749999 0.500000 Mn\n0.750000 0.249999 0.500000 Fe\n0.630961 0.630959 -0.000001 Ge\n0.369040 0.369039 -0.000001 Ge\n",
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"structure_string": "Li4 Cu4 Te4 O16\n1.0\n6.147920 0.000000 0.000000\n0.000000 6.147920 -0.000000\n-0.000000 0.000000 8.630531\nLi Cu Te O\n4 4 4 16\ndirect\n0.000000 0.206175 0.000000 Li\n0.000000 0.793825 0.500000 Li\n0.206175 0.000000 0.250000 Li\n0.793825 0.000000 0.750000 Li\n0.248741 0.248741 0.625000 Cu\n0.248741 0.751259 0.875000 Cu\n0.751259 0.248741 0.375000 Cu\n0.751259 0.751259 0.125000 Cu\n0.776861 0.500000 0.750000 Te\n0.500000 0.776861 0.500000 Te\n0.500000 0.223139 0.000000 Te\n0.223139 0.500000 0.250000 Te\n0.736660 0.978346 0.502585 O\n0.736660 0.021654 0.997415 O\n0.733702 0.482777 0.984079 O\n0.733702 0.517223 0.515920 O\n0.517223 0.733702 0.734079 O\n0.517223 0.266298 0.765920 O\n0.482777 0.733702 0.265920 O\n0.021654 0.736660 0.252585 O\n0.266298 0.517223 0.484079 O\n0.266298 0.482777 0.015920 O\n0.263340 0.978346 0.497415 O\n0.263340 0.021654 0.002585 O\n0.978346 0.263340 0.752585 O\n0.021654 0.263340 0.247415 O\n0.482777 0.266298 0.234080 O\n0.978346 0.736660 0.747415 O\n",
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"structure_string": "K2 In1 Hg1 Cl6\n1.0\n6.521313 -0.000000 3.765082\n2.173771 6.148352 3.765082\n-0.000000 -0.000000 7.530163\nK In Hg Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Hg\n0.759541 0.240459 0.240459 Cl\n0.240459 0.240459 0.759541 Cl\n0.240459 0.759541 0.759541 Cl\n0.240459 0.759541 0.240459 Cl\n0.759541 0.240459 0.759541 Cl\n0.759541 0.759541 0.240459 Cl\n",
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