MMs02403498 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2457 1.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4915 2.6030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0085 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7542 1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 1.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0085 2.5883 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5085 2.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 1.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 1.2770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5085 2.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0084 2.5686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7627 3.8750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3661 4.9123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2627 3.8799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 5.1814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0245 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3408 -0.3351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8854 -1.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9968 -2.4002 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9576 -3.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2983 -1.6544 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6089 -2.8135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9912 -0.1862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6666 -2.2690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8830 -1.3913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8351 -3.8914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7457 1.3113 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7542 -1.2770 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.4915 2.6128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9915 2.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7372 3.9192 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5966 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1034 -1.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0881 3.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6119 3.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6508 0.2446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8481 -0.7894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1769 -2.3613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9923 -3.2616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5271 -3.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9777 -1.8829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8037 -4.5999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3737 -0.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7122 -1.1664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8938 0.6102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1263 0.4337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3625 3.0195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 3.7952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8892 2.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1204 2.2109 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 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 19 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 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 35 36 1 0 0 0 0 35 54 1 0 0 0 0 35 55 1 0 0 0 0 M END