MMs00030670 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 0.7485 -1.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2485 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -2.6016 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5970 -1.5624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4969 -2.6034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2454 -3.9033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2485 -1.3052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7485 -1.3070 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1485 -0.2677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4969 -2.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9969 -2.6086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7485 -1.3105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0106 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4000 1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5489 1.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5292 2.4854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9824 1.8273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2206 0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4608 1.8230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8116 1.1709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9223 -0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6822 -1.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3314 -0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2313 -1.5365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6720 -2.9703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2732 -0.9770 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.9939 -5.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0399 0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 -0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4515 -1.2999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 -1.9969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6043 -3.6366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0355 -3.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0415 -0.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3766 -0.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6497 -0.2653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3688 -3.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7039 -3.7889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7872 -3.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1241 -3.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3728 0.4029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7098 1.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1626 3.0137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3722 3.0197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8037 1.8460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7708 -2.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -5.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5927 -6.2396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0338 -4.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 -3.8998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0454 -3.8983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 54 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 54 55 1 0 0 0 0 M END