MMs00771221 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 0.7573 -1.2948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0146 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4853 -2.6065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -3.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4707 -5.2045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0293 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -3.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2719 -3.8844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0293 -5.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2866 -6.4824 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5292 -5.1707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2865 -6.4655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5439 -7.7687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7865 -6.4570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5292 -5.1538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0292 -5.1453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7865 -6.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0438 -7.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5438 -7.7518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8012 -9.0551 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.2864 -6.4317 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -3.9182 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4853 -2.6234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4706 -5.2214 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0358 0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6059 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0358 -0.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0912 -1.5707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0648 -6.2471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6351 -6.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8661 -2.8418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1234 -4.1281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9233 -4.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6233 -4.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6497 -8.7792 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 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 2 0 0 0 0 6 30 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 13 14 2 0 0 0 0 13 15 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 22 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END