MMs03111864 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 0.7514 -1.2983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2514 -1.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0027 -2.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3941 -3.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5098 -4.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8081 -4.2171 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4947 -2.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4972 -1.6344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9647 -1.9447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4298 -3.3708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9673 -0.8290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4348 -1.1393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4373 -0.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9723 1.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9749 2.5184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4424 2.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9074 0.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9049 -0.3338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3699 -1.7599 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.1995 -6.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7734 -6.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6576 -5.8985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -4.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0386 0.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6011 1.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0386 -0.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1252 -0.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9489 -0.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4156 0.2841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7983 1.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6028 3.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2444 3.1006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0815 0.5337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3988 -6.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3677 -7.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3379 -7.9599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8286 -7.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0228 -6.9168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4555 -5.4501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7997 -3.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2314 -4.3903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 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 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END