MMs00031658 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 56 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 -0.7561 1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0123 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4877 2.6052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2438 1.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2315 3.9077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4754 5.2032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7315 3.9148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4876 2.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9876 2.6265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7315 3.9290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9753 5.2245 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3753 6.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4753 5.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 6.6237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4897 7.7176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9468 7.0740 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1901 6.2333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4252 7.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7799 6.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8994 4.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6643 4.0940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3096 4.7380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2156 3.7118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6647 2.2806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2541 4.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3737 2.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7283 2.1617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9635 3.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8439 4.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4892 5.1522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3181 2.3688 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9561 1.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6172 3.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4438 1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1049 -1.0293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 2.2036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7016 1.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7848 1.4437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1172 2.2214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3458 5.6225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6781 6.4002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1200 8.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3295 8.2806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7680 7.1213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7599 2.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3856 2.1249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8240 0.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8320 5.1890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3936 6.3484 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 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 37 1 0 0 0 0 6 38 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 15 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 45 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 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 M END