MMs01647435 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 1.3049 -0.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3167 -2.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6215 -2.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9147 -2.2193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -0.7194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2195 -2.9591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5127 -2.1989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8175 -2.9387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1107 -2.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -0.6786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -0.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6969 -0.6582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7086 -2.1581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 0.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2949 -0.6378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5880 0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5762 1.6223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8929 -0.6174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9046 -2.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2095 -2.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5026 -2.0970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4909 -0.5970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1860 0.1428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5918 -1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2822 -2.8479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 -4.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9374 -0.1112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5886 1.2204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 -4.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1546 -2.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7846 1.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4570 -0.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3826 1.2816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2114 1.0152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7541 1.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3043 -1.8378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8929 0.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7213 -1.9183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5031 -3.2482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4454 -3.7824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9881 -3.7703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9219 -3.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6827 -1.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6742 -0.7961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8924 0.5338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4074 1.0559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9501 1.0681 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 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 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 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 27 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END