MMs01330632 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 1.2970 -0.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6021 1.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3051 2.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0041 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3092 3.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6103 4.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9073 3.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9032 2.2394 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9032 1.0394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2002 1.4859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5013 2.2323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5054 3.7323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7983 1.4788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0993 2.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3963 1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0912 -0.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4931 -0.7676 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6893 -0.7818 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6974 2.2182 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4439 0.9172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9509 3.5193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9985 2.9647 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2955 2.2112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5965 2.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6006 4.4576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3036 5.2112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0026 4.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2937 -1.9535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6357 -0.6099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0335 2.1028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1269 3.5413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9019 4.8752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 5.4143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3841 5.4101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3208 4.8659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0885 3.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1969 0.2859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1026 3.4253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0879 -1.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5216 1.2940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0643 1.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0039 1.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7789 3.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0775 6.1283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5348 6.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8202 4.2595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5952 5.5934 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END