MMs01748252 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.7522 -1.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2522 -1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -2.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2567 -3.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7567 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0044 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0089 -5.1910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5009 -5.3452 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6601 -5.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8153 -6.8119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9318 -7.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -9.1851 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -9.0308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0305 -9.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5176 -7.5642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4011 -6.5624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9345 -6.8767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3984 -7.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5027 -4.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0368 -2.8030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0385 -1.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5063 -1.9959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9723 -3.4217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9705 -4.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 -3.7311 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.4418 -2.6146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9060 -5.1569 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0382 0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8504 -0.2549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6044 -2.5919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1585 -4.9361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1955 -2.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6499 -8.6727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5718 -7.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1469 -6.3260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4497 -2.6793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6658 -0.5460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3077 -1.1028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3433 -5.6788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END