MMs01388845 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3049 -0.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -0.7193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9147 -2.2193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6216 -2.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3167 -2.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6334 -4.4794 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.2196 -2.9590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5127 -2.1988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -0.6989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8176 -2.9386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1107 -2.1784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4156 -2.9181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4274 -4.4181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7087 -2.1579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0136 -2.8977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3067 -2.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2949 -0.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 0.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6969 -0.6580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5918 -1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5886 1.2204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9374 -0.1112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2822 -2.8479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -4.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0535 -3.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5961 -3.8517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0230 -4.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3506 -2.7293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3294 -0.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9805 1.3022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 M END