MMs03795227 MOE2007 2D CORINA 3.40 0006 02.08.2006 21 22 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 -1.4999 -0.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2608 1.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5218 2.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0218 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7391 1.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7172 3.9033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0437 5.1960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2172 3.9159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7608 1.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6322 0.0466 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0627 0.4981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2687 -0.3937 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0753 1.9981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6526 2.4736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6087 -1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0912 -1.0568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1305 3.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5476 6.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8084 4.9601 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 M END