MMs02727439 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 0.8916 -1.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4399 -2.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6606 -3.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8668 -2.6166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3916 -1.1939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2972 -3.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4036 -2.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0797 -0.5909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1861 0.4219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6164 -0.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9404 -1.4945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8339 -2.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1579 -3.9719 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6729 -5.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9829 -3.1118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1058 -2.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.6476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5285 -2.5926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7493 -1.7209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9555 -2.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4802 -4.0353 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1776 -5.0119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9803 -4.0229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7616 -0.2210 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0668 0.5183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4688 0.5397 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9650 0.7133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7133 0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.7133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7425 -4.1325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2488 -3.7994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9354 -0.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 1.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5016 0.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 -1.8559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -5.0181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6828 -6.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8729 -4.9983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2227 -4.2876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0998 -2.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END