MMs01414858 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.2967 -0.7540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2921 -2.2540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 1.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9041 2.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2008 1.4839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8948 -0.7620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4928 -0.7701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7988 1.4759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0909 -0.7781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6890 -0.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6843 -2.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9810 -3.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9764 -4.5402 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2731 -5.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2685 -6.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5652 -7.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8665 -6.8022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8712 -5.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5745 -4.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1633 -7.5562 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6032 1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0374 0.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6032 -1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5653 2.0952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9078 3.4379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2418 2.0807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8911 -1.9620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4891 -1.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3167 -1.6950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8594 -1.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5032 -2.0741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2704 -3.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3950 -1.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1622 -3.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2274 -7.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5615 -8.7482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9123 -4.7054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5782 -3.3482 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END