MMs01931165 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.0068 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2888 2.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5912 1.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3024 -0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8868 2.2677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1893 1.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4849 2.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7873 1.5355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0829 2.2914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3854 1.5473 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3854 2.7473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6946 -0.6967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0622 -0.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0709 -1.1905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2638 -1.0597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3269 -2.4930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8582 -2.1878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6810 2.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9834 1.5592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 3.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7736 4.5355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1756 4.5236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 3.7677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5776 4.5118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 -0.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0488 2.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2833 3.4559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -0.5834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 -1.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7928 0.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0775 3.4914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2095 0.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9869 -1.0822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3063 1.0945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8199 -3.5870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 5.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6741 3.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7106 4.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 41 42 1 0 0 0 0 M END