MMs01053237 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.7589 1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0178 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4822 2.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2233 3.9124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4644 5.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0356 5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7767 3.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2766 3.8816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0355 5.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2944 6.4796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5355 5.1652 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9355 6.2044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2766 3.8611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5177 2.5672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2944 6.4591 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7943 6.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6677 5.2293 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3213 8.8001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0974 5.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1077 7.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6843 7.6563 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4118 7.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7057 7.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6954 5.6652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3913 4.9241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0351 0.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6071 -1.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 -0.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6728 0.5162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6834 2.0589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0893 1.5732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4232 3.9206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0572 6.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6427 6.2311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8695 2.8383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2011 4.6261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1905 3.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4826 3.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9106 1.5321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5528 1.9601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4200 9.1240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7490 7.7581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7305 5.0581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 26 2 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END