6145 -OEChem-10201905093D 18 18 0 0 0 0 0 0 0999 V2000 2.3069 -1.3072 0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1524 0.7461 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4619 0.6643 -0.0006 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1915 0.3708 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 1.3469 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5386 -0.9803 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5316 0.9721 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8822 -1.3550 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8786 -0.3788 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2893 -0.0790 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 2.4035 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1755 -1.7918 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3308 1.7474 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3075 1.7321 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -2.4067 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9247 -0.6707 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3697 0.2114 -0.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 1.6786 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 3 10 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 9 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 16 1 0 0 0 0 M END > 6145 > 0.4 > 1 8 5 11 7 6 10 4 9 2 3 > 18 1 -0.57 10 0.69 11 0.15 12 0.15 13 0.37 14 0.15 15 0.15 16 0.15 17 0.37 18 0.37 2 -0.55 3 -0.8 4 0.12 5 -0.15 6 -0.15 7 -0.15 8 -0.15 9 -0.15 > 2 > 4 1 1 acceptor 1 2 donor 1 3 donor 6 4 5 6 7 8 9 rings > 10 > 0 > 0 > 0 > 0 > 0 > 1 > 3 > 0000180100000001 > 27.6699 > 20.346 > 10857977 72 18340759442136940001 12897270 3 18410575119281306172 12932764 1 17417804063044455462 13024252 1 15719109167428938953 14325111 11 18410575050366806465 16945 1 18410574015458899781 20201158 50 18413669123405854942 20871998 184 18201443639781422039 23552423 10 18260550064585163791 369184 2 18272368663701234529 > 189.96 4.79 1.44 0.59 2.75 0.13 0 -0.12 0 -0.39 0 -0.07 0 0 > 392.343 > 108.1 > 2 5 10 $$$$