MMs03776676 MOE2007 2D CORINA 3.40 0006 02.08.2006 20 20 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 -0.7555 1.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 2.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2445 1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7445 1.3149 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7381 2.8149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 -0.1851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2445 1.3213 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 5.8488 0.2846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7665 3.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2665 3.8876 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5956 -1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9555 1.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0846 3.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1044 -1.0303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6264 6.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8709 4.9242 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 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 M CHG 1 10 -1 M END