MMs01015541 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.7553 1.2960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0106 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4894 2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2341 3.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4788 5.2022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0212 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7659 3.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2659 3.8879 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0212 5.1839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2765 6.4859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5212 5.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2765 6.4737 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7765 6.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6532 5.2505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7165 5.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0816 5.7082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3776 4.9529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6797 5.6975 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6858 7.1975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3899 7.9528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0878 7.2081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6631 7.6775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2235 6.5043 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7341 3.9124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4894 2.6164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0368 0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6042 -1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0368 -0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0936 1.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6255 6.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8616 2.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 3.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6471 4.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3727 3.7529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7275 7.7933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3948 9.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5261 3.2207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0936 1.5797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4526 2.0122 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 31 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 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 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 25 26 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END