MMs03454363 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 -0.7475 -1.3005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5049 -2.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2574 -3.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5098 -5.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7426 -3.8985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2426 -3.9014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9902 -5.2018 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6897 -5.9494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2906 -4.4543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7377 -6.5023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9853 -7.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7328 -9.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2328 -9.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9852 -7.8056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2377 -6.5051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4852 -7.8084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2377 -6.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4902 -5.2103 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7377 -6.5136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4902 -5.2160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9901 -5.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7377 -6.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2377 -6.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9901 -5.2245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2426 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7426 -3.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4901 -5.2274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9901 -5.2302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9803 -10.4036 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0404 -0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1029 -1.5549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4574 -3.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1118 -6.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5882 -6.2365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8446 -2.8633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7853 -7.7976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1308 -10.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8397 -5.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0833 -8.8488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5271 -7.6950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8645 -6.9262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1357 -7.5574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8357 -7.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8446 -2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1446 -2.8809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 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 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 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 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 3 0 0 0 0 M END