7150 -OEChem-03192404243D 18 18 0 0 0 0 0 0 0999 V2000 2.0538 -0.7845 0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8766 1.5107 -0.0008 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.1539 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.2330 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5766 -1.1512 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3444 1.0072 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9532 -1.3770 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -0.2978 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3509 0.3895 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4819 -0.6837 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 2.2575 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0733 -2.0217 -0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0329 1.8472 0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3376 -2.3929 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9087 -0.4737 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8225 -0.1632 0.9009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8236 -0.1638 -0.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8947 -1.6958 0.0016 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 9 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 5 7 2 0 0 0 0 5 12 1 0 0 0 0 6 8 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 M END > 7150 > 0.4 > 1 2 > 15 1 -0.43 10 0.28 11 0.15 12 0.15 13 0.15 14 0.15 15 0.15 2 -0.57 3 0.09 4 -0.15 5 -0.15 6 -0.15 7 -0.15 8 -0.15 9 0.63 > 2 > 2 1 2 acceptor 6 3 4 5 6 7 8 rings > 10 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 00001BEE00000001 > 27.7518 > 10.148 > 12032990 46 18336270136667424915 13024252 1 15430040937578395377 14325111 11 18410575088963522337 16945 1 18410855413078778311 19973954 147 18410857702127775889 20201158 50 18343302535265019326 20871998 184 18202004377747610103 21040471 1 18410855421853400677 23402539 116 17988069016329306773 23463225 33 18191302680966894962 23552423 10 18188490288688018710 2748010 2 18338232786007113661 369184 2 18343020021090533905 5084963 1 18343017783291299009 7364860 26 18270400628404101776 > 194.06 4.63 1.5 0.6 2.55 0.09 0 -0.68 0 -0.25 0 -0.04 -0.01 0 > 401.587 > 111.8 > 2 5 10 $$$$