MMs00539978 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 39 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 1.3053 0.7390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5853 -1.5219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 0.7170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0440 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5013 0.6950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 -0.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0993 0.6730 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1385 1.2730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1120 2.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8193 2.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8320 4.4339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 2.1949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 -0.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3792 -1.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6719 -2.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9772 -1.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 -0.1100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6973 0.6510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2953 0.6290 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 15.5879 -0.1320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3080 2.1290 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.7813 -1.5659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7686 -3.0659 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5912 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 -0.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5912 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1398 1.6427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6824 1.6297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2920 1.9546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 3.2971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4799 2.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3350 -2.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6617 -3.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7074 1.8510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2699 -2.3709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2597 -3.5708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 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 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 3 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END