MMs00089939 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 1.4176 0.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5511 -0.4921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2527 1.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1192 2.4536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7017 1.9632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6703 1.9616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8038 0.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2648 1.3187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9902 2.6316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4899 2.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2643 1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0392 0.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0568 -1.0994 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6752 -0.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3906 -1.2898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7640 1.4037 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 11.2152 3.9730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3923 1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1341 -0.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3923 -1.1341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3238 -1.6703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8754 -0.7876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3465 3.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7949 2.7492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3706 3.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1585 -0.9653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3284 -2.2683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2656 3.3927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7955 5.0233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1648 4.5532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 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 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 M END