MMs01042025 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 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 1.2925 -0.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2796 -2.2611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5722 -3.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8776 -2.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8905 -0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1702 -3.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4756 -2.3058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7681 -3.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 -4.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0736 -2.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3661 -3.0893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6716 -2.3505 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9328 -1.0450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4104 -3.6559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9770 -1.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1466 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6165 0.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3553 -1.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3420 -2.2335 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.8456 -1.2971 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6089 1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.6089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6089 -1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2353 -2.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5619 -4.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9349 -0.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6083 1.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3909 -3.9572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9336 -3.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4859 -1.1058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3102 -1.4023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8528 -1.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3558 -4.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2618 0.6893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1140 1.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 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 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M END