MMs01139005 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 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 0.7522 -1.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2522 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7565 -3.8959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0086 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4914 -5.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2435 -3.9009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2392 -6.4989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7392 -6.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6189 -7.7164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0462 -7.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0487 -5.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6229 -5.2894 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2565 -3.8934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0043 -2.5931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0086 -5.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2608 -6.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -7.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -7.7867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2608 -6.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5086 -5.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7608 -6.4840 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 0.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6017 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 -0.6017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3522 -0.2586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -2.4953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4522 -1.2933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 -0.0953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9162 -1.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9136 -3.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -5.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1978 -6.3783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6375 -7.5372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0159 -7.9622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0207 -5.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0608 -6.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4147 -8.8295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1147 -8.8250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1069 -4.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 M END