MMs01311584 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 -1.0444 -1.0767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -0.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9093 0.7323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3639 1.0984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4083 0.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5434 -1.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2435 -2.2571 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4234 -1.3310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9072 0.0774 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8662 -1.7412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9429 -0.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5768 0.7578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3857 -1.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4624 -0.0627 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.9052 -0.4730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0852 0.4532 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.0406 1.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3306 -0.3828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9204 -1.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4214 -1.8813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.7390 0.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.8902 -0.8283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.2986 -0.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.5558 1.1657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4046 2.1273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9962 1.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8613 -0.8355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8355 0.8613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8613 0.8355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0738 1.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6921 2.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2152 -2.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1591 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8621 -2.1868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3581 -1.8103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6613 -2.7696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.6845 -2.0105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.2196 -1.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.6825 1.5786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.6103 3.3095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0752 2.3804 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 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 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END