MMs01258339 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 1.4985 0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3054 -1.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8026 -1.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1792 -2.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9147 -3.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7566 -2.5940 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9812 -5.0459 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3122 -5.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5767 -4.9307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5103 -3.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7748 -2.6253 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1058 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3703 -2.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3038 -1.0116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7013 -3.2018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9658 -2.3950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8993 -0.8964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1638 -0.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4948 -0.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5613 -2.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2968 -3.0866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7594 0.0256 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0532 1.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1988 -0.0532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0532 -1.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 1.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6069 0.5265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5653 -0.3620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3654 -6.9364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3759 -4.2695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9171 -4.2011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7545 -4.4006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8345 -0.3431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1106 1.1092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6261 -2.8331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 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 36 1 0 0 0 0 M END