MMs00180522 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.2762 -1.4744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7543 -2.5644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0361 -3.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4383 -3.6051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6313 -2.1176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9481 -1.3993 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2286 -2.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1921 -3.6802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5454 -1.4624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5818 0.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8987 0.7554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1792 -0.0259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1427 -1.5255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8259 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4232 -2.3068 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.7400 -1.5886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3868 -3.8064 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2418 -2.3714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1527 -3.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6403 -3.3702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2169 -1.9855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -0.7937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8185 -0.9867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7045 -1.7925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6153 -2.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1795 0.2209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2209 1.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1795 -0.2209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5506 -4.9653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9773 -0.1997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5575 0.6622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9278 1.9550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2327 0.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7967 -3.4434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6914 -4.6710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -4.3236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7674 0.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0898 -0.0333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5687 -2.2556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3440 -3.9377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6619 -3.7130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END