MMs01083678 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 -1.5000 -0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2567 1.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5134 2.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0135 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7433 1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7298 3.9009 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7567 1.2796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 -0.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7566 1.2640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7432 -1.3340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2432 -1.3418 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9864 -2.6447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4864 -2.6525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2297 -3.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7296 -3.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6176 -2.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0418 -3.2251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0340 -4.7251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6050 -5.1812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.2429 -5.6130 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -16.0784 -7.1040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.6164 -5.0100 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0946 -1.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1188 3.6264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9432 1.3091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3702 -0.4279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7022 -1.2062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1378 -2.3701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3810 -3.6808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0918 -1.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6243 -4.9915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2527 -1.6110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0162 -2.5248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 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 31 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END