MMs01441057 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 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 -0.7539 -1.2968 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3539 -0.2575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2539 -1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0078 -2.5890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2539 -1.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7539 -1.2786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 1.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2461 1.3149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0272 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0078 -2.5981 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4921 -2.6026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2382 -3.9039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7704 -5.3291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9812 -6.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1974 -5.3364 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7382 -3.9084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4921 -2.6117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7461 -1.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 -1.3058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5134 -7.6396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0134 -7.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5542 -6.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0374 -0.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6031 1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0374 0.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3969 1.0465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -2.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -2.3161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3429 2.3605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3492 -0.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6864 -7.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3844 -8.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1353 -8.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1611 -7.8810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0427 -5.1660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5435 -6.6919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 2 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 26 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END