MMs03548078 MOE2007 2D CORINA 3.40 0006 02.08.2006 21 21 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 -0.7463 1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5075 2.5938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 3.8906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2537 1.2926 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2463 -1.3055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7537 1.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7537 1.2796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9463 1.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6433 -2.3430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4463 -1.3090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5487 2.4706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8825 1.6954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3712 -0.4201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -1.1953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7462 -1.3184 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 2 0 0 0 0 1 13 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 M CHG 1 21 -1 M END