MMs01369227 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.2942 -0.7583 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2550 -1.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2846 -2.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5788 -3.0166 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5396 -3.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8826 -2.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8922 -0.7749 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2056 1.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4903 -0.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0883 -0.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0787 -2.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6863 -0.8248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9997 1.4168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7055 2.1751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4017 1.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2843 -0.8414 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.5692 -4.5165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1042 -2.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -3.3832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2858 -3.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0657 -2.0741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8326 0.9075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3752 0.8977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7130 -1.7059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2557 -1.7157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6786 -2.0248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0428 2.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3663 2.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3692 -4.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5615 -5.7165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7692 -4.5242 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 31 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 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END