MMs00698555 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 -1.3150 -0.7217 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2757 -1.3217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3475 -2.2213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6624 -2.9430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9449 -2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9124 -0.6654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3287 -0.1711 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2364 -1.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3812 -2.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8755 -4.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3491 -4.2938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8962 -5.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3905 -6.5662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7361 -1.3328 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4577 -0.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6798 1.2647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9574 0.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6791 1.3296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1787 1.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9567 0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4563 0.1121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1780 1.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4001 2.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9004 2.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1225 3.9596 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -16.6777 1.4596 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.5975 0.0563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5774 -1.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 0.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5774 1.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1615 -2.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9615 -3.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9112 -3.8788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4535 -3.8454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5235 -6.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -7.6992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2575 -6.9617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3584 -2.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7747 -1.1713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0936 -0.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3793 -0.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0787 -0.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9774 3.7616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8064 0.9586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3487 0.9920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END