MMs01725862 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 1.4548 -0.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4988 0.7114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9535 0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9976 1.4228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4523 1.0572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8630 -0.3855 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4630 -1.4247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3057 0.0253 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1542 0.8738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 1.4679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6247 2.7785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6163 -0.7044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9035 0.0657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8801 1.5655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2140 -0.6640 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2533 -1.2640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5012 0.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8118 -0.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0990 0.1466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0757 1.6464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7651 2.3761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4779 1.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3629 2.4165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4113 1.8328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -1.4625 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3643 -1.0969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5868 2.8655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6308 3.9425 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2925 1.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1638 0.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2925 -1.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7833 -1.5198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1702 1.8655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6350 -1.9043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8305 -1.8234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1474 -0.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7464 3.5759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4294 2.1897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1706 -1.2201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2783 -2.2938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2374 -2.1638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2076 -2.7799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2858 -2.7476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1321 3.2311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 35 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 18 1 0 0 0 0 16 42 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 45 2 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 29 -1 M END