MMs01748973 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.2941 -0.7585 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2548 -1.3585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2842 -2.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5783 -3.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8822 -2.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8921 -0.7756 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4901 -0.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9022 -1.0623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2831 -2.4285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7923 -2.2619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9835 -3.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1567 -3.6478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6495 -3.5008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2686 -2.1346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3949 -0.9153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0140 0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5068 0.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 1.4487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 2.2072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2059 1.4658 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6068 1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0353 0.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6068 -1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1038 -2.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8664 -3.3834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8009 -3.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3436 -3.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2852 -3.4059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0654 -2.0750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8327 0.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3754 0.8971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6615 -4.7408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3485 -4.4763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4628 -2.0170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6244 -0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7010 0.7156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3892 1.7922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5177 3.4072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 24 2 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 14 1 0 0 0 0 13 16 2 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 M END