nchem.20051284C-comp30.mol ChemDraw02052119412D 35 37 0 0 0 0 0 0 0 0999 V2000 -0.2956 2.5706 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5114 2.7422 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9239 2.0277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3719 1.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3818 1.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7444 1.9415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 1.1878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0963 1.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8107 1.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5252 1.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5252 0.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8107 0.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0963 0.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9306 -0.2333 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7511 -0.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 0.3479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9004 1.1016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2397 -0.7248 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9071 -1.2098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6522 -1.9944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8272 -1.9944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5722 -1.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3422 -2.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5218 -2.5756 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2397 0.1002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0866 -1.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9071 -1.1595 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2709 -1.5004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5539 -1.9143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2709 -0.6725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9878 -1.9143 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1630 -2.3282 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5539 -2.7422 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -1.5004 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 27 28 3 0 16 27 1 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 1 1 0 3 6 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 8 1 0 8 5 1 0 6 7 1 0 7 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 7 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 19 1 0 22 24 1 0 24 25 1 0 11 26 1 0 26 19 1 0 29 30 1 0 29 31 2 0 29 32 1 0 30 33 1 0 30 34 1 0 30 35 1 0 M CHG 2 25 1 32 -1 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 2 27 28 M SBL 1 1 2 M SMT 1 CN M SBV 1 2 -0.3356 0.7537 M END