MMs01452725 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 0.7521 -1.2978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3521 -0.2586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2521 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0043 -2.5931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2479 1.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 1.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7521 -1.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2521 -1.2904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0148 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 -2.5981 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4957 -2.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3754 -3.8155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8028 -3.3543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8052 -1.8543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3794 -1.3885 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0148 -4.2380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3862 -3.6301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5982 -4.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 -6.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0677 -6.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8556 -5.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 0.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6017 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3983 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6462 2.3459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3461 2.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3538 -2.3262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7772 -1.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5135 -2.4369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6953 -4.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4086 -6.7123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9403 -7.8064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7585 -6.2158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 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 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 33 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 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END