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{
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{
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{
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"structure_string": "V1 H12 C2 S2 O12 F6\n1.0\n3.546792 9.437771 0.000000\n-3.546792 9.437771 0.000000\n0.000000 1.572839 6.459056\nV H C S O F\n1 12 2 2 12 6\ndirect\n0.000000 0.000000 0.000000 V\n0.817281 0.043514 0.690037 H\n0.043514 0.817281 0.690037 H\n0.182719 0.956486 0.309963 H\n0.956486 0.182719 0.309963 H\n0.826785 0.335578 0.700839 H\n0.335578 0.826785 0.700839 H\n0.173215 0.664422 0.299161 H\n0.664422 0.173215 0.299161 H\n0.777555 0.400833 0.927153 H\n0.400833 0.777555 0.927153 H\n0.222445 0.599167 0.072847 H\n0.599167 0.222445 0.072847 H\n0.274260 0.274260 0.711569 C\n0.725740 0.725740 0.288431 C\n0.375468 0.375468 0.689725 S\n0.624532 0.624532 0.310275 S\n0.382692 0.382692 0.904041 O\n0.617308 0.617308 0.095959 O\n0.227072 0.575084 0.575548 O\n0.575084 0.227072 0.575548 O\n0.772928 0.424916 0.424452 O\n0.424916 0.772928 0.424452 O\n0.948842 0.948842 0.746089 O\n0.051158 0.051158 0.253911 O\n0.856861 0.286342 0.845943 O\n0.286342 0.856861 0.845943 O\n0.143139 0.713658 0.154057 O\n0.713658 0.143139 0.154057 O\n0.260709 0.260709 0.520186 F\n0.739291 0.739291 0.479814 F\n0.088770 0.399103 0.814509 F\n0.399103 0.088770 0.814509 F\n0.911230 0.600897 0.185491 F\n0.600897 0.911230 0.185491 F\n",
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{
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{
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}