MMs01263361 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 1.3015 -0.7456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3066 -2.2456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6081 -2.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9046 -2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2062 -2.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2112 -4.4826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9147 -5.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6131 -4.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3166 -5.2456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 -2.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 -2.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8093 -4.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8143 -5.9739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1007 -2.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0957 -0.7195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4023 -2.9652 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6988 -2.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6938 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2919 -0.7021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2969 -2.2021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0004 -2.9565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5984 -2.9478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8949 -2.1934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8899 -0.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 0.0522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5965 1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 0.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7082 0.3834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -0.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2524 -5.0791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9187 -6.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3206 -6.4456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4987 -1.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4063 -4.1652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6526 -0.1143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9863 1.2435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0044 -4.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3091 -3.3197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0760 -1.9811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0724 -0.8979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2966 0.4355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 3 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 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END