MMs00693613 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 -1.3006 -0.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3036 -2.2474 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0919 -3.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5583 -4.5571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3209 -5.7725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0583 -4.5541 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5189 -3.1266 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3675 -3.9751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9446 -2.6601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2534 -1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6791 -0.7259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7958 -1.7273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 -3.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0613 -3.6616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2215 -1.2609 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.9424 -5.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4424 -5.7628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9089 -7.1884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6971 -8.0725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4818 -7.1933 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3356 -2.6709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5979 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0404 0.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5979 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -0.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9262 0.4484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3804 -3.9963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8142 -4.8358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0509 -7.5569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6996 -9.2725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2644 -1.6474 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 23 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 M END