MMs01411712 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 52 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 1.5000 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2411 1.3143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4823 2.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0176 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7411 1.3245 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7309 2.8244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7513 -0.1755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2411 1.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9822 2.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4822 2.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 1.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 0.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2586 -1.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5175 -2.5471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7586 -1.2328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5174 -2.5268 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1174 -3.5660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7762 -3.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0174 -2.5166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7762 -3.8105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7585 -1.2125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2585 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0173 -2.4962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5173 -2.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2584 -1.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4996 0.1120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9997 0.1018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7584 -1.1718 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0041 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0081 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2996 -1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6304 -0.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6072 3.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2659 3.7885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0258 3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2176 2.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0136 1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3752 3.6739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0751 3.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4410 1.3631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4069 -1.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7329 -3.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1833 -4.8741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8195 -4.4238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1515 -0.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4244 -3.5395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1243 -3.5212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0926 1.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 M END