MMs01061262 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 36 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 -0.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2532 1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5064 2.5944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0064 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7468 1.3009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7405 3.8989 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7532 1.2899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7468 -1.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8787 -1.2304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3064 -0.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3101 0.7297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8846 1.1967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4187 -1.7768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9108 -1.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5176 -2.9954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4004 -3.9964 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.1032 -3.2432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6755 -3.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5632 -2.6968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6025 -1.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0975 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1089 3.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9468 1.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3557 2.3276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5134 -0.5859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6907 -3.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2363 -4.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7281 -4.4397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4517 -2.2446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9248 -3.7129 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 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 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 M END