MMs01845307 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.1123 1.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 2.4728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7981 3.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 4.8872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4215 4.5718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5747 3.0797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 2.3266 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1728 3.0735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4701 2.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4665 0.8205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7709 3.0674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0681 2.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0646 0.8144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3619 0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6627 0.8082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6662 2.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3689 3.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3725 4.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9599 0.0552 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.2902 3.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9036 2.0677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3957 1.9145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2745 3.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6612 4.4989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 4.6522 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8051 0.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8899 -0.8051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8051 -0.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7506 -0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2239 1.4585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4036 3.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9463 3.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7737 4.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 0.2168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3590 -1.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7069 2.9058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1725 4.5641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3753 5.7613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5725 4.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2005 1.0953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8864 0.8194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4682 3.0074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3642 5.4714 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END