MMs01079180 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.4735 0.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4532 -0.8553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9268 -0.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9065 -1.7106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5634 -3.1709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2487 -3.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2167 -5.3927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4995 -6.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8142 -5.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8462 -3.9484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 -2.9687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4423 -3.3118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4695 -2.2187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9298 -2.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3628 -3.9979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9570 -1.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4451 -1.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0842 -0.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9912 0.7270 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6764 0.0049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5908 0.5162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5578 -0.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4013 -1.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1788 -0.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4675 -7.6699 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2244 1.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1788 -0.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2244 -1.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0478 1.4025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5045 0.8946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4223 -1.4694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -1.9773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5011 0.5472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9578 0.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2225 -3.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 -5.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8404 -6.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1231 -1.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0228 -2.7090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7822 -1.1985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7366 0.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3334 1.1592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 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 40 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 M END