MMs02437130 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 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 1.4257 -0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9536 0.9380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4335 1.1829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3855 0.0237 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9855 1.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8577 -1.3803 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5471 -2.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3778 -1.6252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0299 -2.3162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0691 -2.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2822 -1.4906 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1307 -0.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8839 -0.0444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6863 -2.0184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0845 -3.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5830 -3.5327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1108 -2.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9386 -1.1928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1630 0.2904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8491 0.3395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5596 0.8376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7318 -0.0983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5074 -1.5814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6796 -2.5173 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7840 2.3207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9618 -3.8147 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2919 -1.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3729 1.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1406 0.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3729 -1.1406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0349 2.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4789 1.7719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3358 -4.4024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9012 2.7585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8462 3.0694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4937 -0.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6152 -2.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0776 -2.3552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 26 35 1 0 0 0 0 26 36 1 0 0 0 0 28 37 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 M CHG 1 27 -1 M END