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-1.4395 -0.1852 1.6443 -0.0972 -0.5283 -0.0343 1.4757 -0.1969 0.2393 0.5437 -1.0082 0.5442 1.3078 -0.6932 0.071 1.5344 -1.7962 -0.3583 -0.9135 -2.1368 1.1304 -0.0644 -0.645 0.7949 -2.404 -1.5613 0.2879 1.4719 0.3256 -0.4143 -2.3837 -1.6564 1.9334 2.4368 0.6156 -1.0702 -0.0437 0.7378 2.4271 -0.4759 -0.9559 -1.6057 1.1377 -1.0509 0.3029 0.573 2.0702 2.1376 Conformer ID 11 2.1 PubChem ncbi.nlm.nih.gov 2012.05.21 04239D3C00000001 Energy MMFF94 NoEstat 7 2.1.0 Szybki TK OpenEye Scientific Software 2019.06.18 59.4082 Feature Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 50.841 Fingerprint Shape 2 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 10 15 16415478246894804992 10299344 5 18259990383239096012 10319926 262 18201452397651943781 10669705 176 9151175367977137128 11135926 11 18261385624982937103 11181472 205 12175626214127546122 11387372 6 17677061256513690083 11963148 33 18115013131483743498 11973863 73 17604424098581102241 11991303 11 14201407117711495192 12107183 9 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3383291 50 18187078494721747970 3504750 166 18340482370335229279 3663271 9 18270121348039738841 393628 179 10015571788708867190 397638 26 17917992784645937623 4169191 19 12751521790413293064 437795 83 8430322354699037567 4516262 110 11887414469296037879 5104073 3 18270963574052071305 54039377 194 16877950438471384617 5470011 282 15502096345705037614 68570916 9 18338797943769436860 9953998 17 18272650138852141929 999808 66 18411411813576481910 Shape Multipoles 8 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 579.85 31.23 2.89 1.41 39.2 1.35 -0.3 9.81 -16.36 -4.9 0.42 -0.54 -0.44 -1.4 Shape Self Overlap 7 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 1219.462 Shape Volume 7 2.0.4 Shape TK OpenEye Scientific Software 2019.06.18 326.5 Conformer RMSD 7 2012.05.21 1.4 Diverse Conformer ID List 6 2012.05.21 1 50 60 115 30 25 54 68 113 64 97 33 106 91 36 28 16 34 71 102 118 83 31 87 55 99 77 74 84 119 8 49 14 116 20 79 104 38 44 37 114 42 2 39 117 32 10 66 53 107 12 45 23 72 40 92 124 109 17 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