MMs03210304 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 57 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 1.5000 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2591 1.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2408 -1.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4816 -2.6086 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6816 -2.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2224 -3.9129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7224 -3.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4632 -5.2278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4815 -2.6298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9815 -2.6404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0184 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7592 -1.2937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7775 -3.8917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1771 -5.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2989 -6.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5926 -5.5029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2704 -4.0380 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4295 -4.3485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2662 -2.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7926 -1.4929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7356 -3.2177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1144 -4.3563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7314 -2.0959 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0419 -3.2550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2578 -0.6726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7884 -0.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2535 0.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2007 -2.3974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6743 -3.8206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0085 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0085 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2941 0.6758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8665 2.3181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2242 1.8904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1654 -0.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1545 -2.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6571 -4.1141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4224 -5.0961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8889 -1.5864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5888 -1.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3446 -4.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5213 -6.2421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4128 -7.0713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0111 -7.2279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0884 -6.5957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7312 -5.1241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9472 0.4865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5472 -1.5466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6129 -0.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0296 0.8044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3561 1.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0502 1.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1510 -0.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1965 -1.2756 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 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 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 M CHG 1 57 -1 M END