MMs00647339 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 -1.2966 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2917 -2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0097 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3063 -2.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3015 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5932 1.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -0.7373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1913 1.5169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4976 -0.7289 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7893 1.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0859 2.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3874 1.5337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0957 -0.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6937 -0.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4395 0.5894 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.9952 -1.4578 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.9479 -2.0135 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.6840 2.2879 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5883 -3.0084 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5835 -4.5084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8898 -2.2626 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0039 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3378 -0.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0136 -4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3475 -2.8424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -1.9373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 2.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5015 -1.9289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7481 2.1219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0820 3.4795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0995 -1.9205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 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 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END