MMs01437242 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3019 -0.7450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3076 -2.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6095 -2.9901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9057 -2.2351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8999 -0.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0198 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2075 -2.9802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5037 -2.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -0.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8056 -2.9703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1018 -2.2154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4036 -2.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4094 -4.4604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6998 -2.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0017 -2.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2979 -2.1956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2922 -0.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6941 -0.7055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0593 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.3433 -1.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8334 1.3555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8845 0.8143 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4826 0.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6337 2.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0997 2.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8547 1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8552 0.2193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6152 -4.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0415 0.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2707 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5935 1.2099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2121 -4.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0378 -3.8925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5804 -3.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0063 -4.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3394 -2.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9857 1.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6526 -0.1095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8800 2.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4186 -0.8530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9612 -0.8471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7389 3.1161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5836 3.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.0485 1.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4152 -4.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6198 -5.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8152 -4.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END