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{
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{
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{
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"structure_string": "H28 W4 C28 N4 O20\n1.0\n10.304423 0.000000 0.000000\n0.000000 9.160906 0.000000\n0.000000 3.292398 11.692427\nH W C N O\n28 4 28 4 20\ndirect\n0.881254 0.633635 0.072951 H\n0.118746 0.366365 0.927049 H\n0.201597 0.660919 0.154477 H\n0.964386 0.458512 0.897824 H\n0.535614 0.458512 0.397824 H\n0.643768 0.388900 0.200372 H\n0.489125 0.816203 0.602983 H\n0.618746 0.633635 0.572951 H\n0.414619 0.490619 0.288709 H\n0.683322 0.196430 0.271370 H\n0.316678 0.803570 0.728630 H\n0.356232 0.611100 0.799628 H\n0.298403 0.660919 0.654477 H\n0.464386 0.541488 0.602176 H\n0.585381 0.509381 0.711291 H\n0.914619 0.509381 0.211291 H\n0.035614 0.541488 0.102176 H\n0.701597 0.339081 0.345523 H\n0.856232 0.388900 0.700372 H\n0.989125 0.183797 0.897017 H\n0.085381 0.490619 0.788709 H\n0.381254 0.366365 0.427049 H\n0.816678 0.196430 0.771370 H\n0.798403 0.339081 0.845523 H\n0.183322 0.803570 0.228630 H\n0.510875 0.183797 0.397017 H\n0.010875 0.816203 0.102983 H\n0.143768 0.611100 0.299628 H\n0.135628 0.181899 0.704176 W\n0.635628 0.818101 0.795824 W\n0.364372 0.181899 0.204176 W\n0.864372 0.818101 0.295824 W\n0.616578 0.036316 0.688175 C\n0.456321 0.405259 0.361657 C\n0.642289 0.301658 0.282702 C\n0.759553 0.895934 0.894747 C\n0.015970 0.857153 0.397226 C\n0.240447 0.104066 0.105253 C\n0.296448 0.224868 0.792753 C\n0.956321 0.594741 0.138343 C\n0.883422 0.036316 0.188175 C\n0.043679 0.405259 0.861657 C\n0.116578 0.963684 0.811825 C\n0.857711 0.301658 0.782702 C\n0.653176 0.605641 0.909065 C\n0.142289 0.698342 0.217298 C\n0.484030 0.857153 0.897226 C\n0.515970 0.142847 0.102774 C\n0.846824 0.605641 0.409065 C\n0.383422 0.963684 0.311825 C\n0.543679 0.594741 0.638343 C\n0.153176 0.394359 0.590935 C\n0.703552 0.775132 0.207247 C\n0.357711 0.698342 0.717298 C\n0.346824 0.394359 0.090935 C\n0.796448 0.775132 0.707247 C\n0.203552 0.224868 0.292753 C\n0.740447 0.895934 0.394747 C\n0.984030 0.142847 0.602774 C\n0.259553 0.104066 0.605253 C\n0.493587 0.726953 0.675096 N\n0.506413 0.273047 0.324904 N\n0.993587 0.273047 0.824904 N\n0.006413 0.726953 0.175096 N\n0.607921 0.750306 0.164181 O\n0.595898 0.122117 0.041132 O\n0.404102 0.877883 0.958868 O\n0.334868 0.060783 0.548217 O\n0.607239 0.160571 0.631024 O\n0.165132 0.060783 0.048217 O\n0.095898 0.877883 0.458868 O\n0.332783 0.510530 0.022386 O\n0.392079 0.249694 0.835819 O\n0.107239 0.839429 0.868976 O\n0.667217 0.489470 0.977614 O\n0.892079 0.750306 0.664181 O\n0.392761 0.839429 0.368976 O\n0.834868 0.939217 0.951783 O\n0.107921 0.249694 0.335819 O\n0.832783 0.489470 0.477614 O\n0.167217 0.510530 0.522386 O\n0.892761 0.160571 0.131024 O\n0.665132 0.939217 0.451783 O\n0.904102 0.122117 0.541132 O\n",
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{
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