MMs00036179 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 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 0.7457 -1.3015 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4543 -1.3015 0.0000 H 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 0.7372 -3.8996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5085 -2.5931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2628 -3.8897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 -1.3064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 1.2916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0148 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9000 -1.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2457 -1.3163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7457 -1.3212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7542 1.2769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 1.2818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5085 2.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0085 2.5882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2628 3.8799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6572 5.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7752 6.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0717 5.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 4.0318 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4914 -2.6227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7372 -3.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9914 -2.6276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7457 -1.3310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2457 -1.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9914 -2.6374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2372 -3.9340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7372 -3.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9829 -5.2355 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0412 0.5966 0.0000 H 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 -1.0412 -0.5966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -3.2863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8662 -4.9270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2255 -4.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8423 -2.3476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1167 -1.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4502 -2.4987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4167 -0.7990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4217 0.7437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8832 1.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5497 2.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4842 5.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6536 7.4460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1696 5.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1491 -0.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8491 -0.2987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1914 -2.6414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1338 -4.9663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 53 1 0 0 0 0 M END