MMs03515653 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 43 0 0 1 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 1.3016 0.7455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8997 0.7365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4977 0.7275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 0.7186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0359 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6939 0.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6991 2.2096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2919 0.7006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2919 -0.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8900 0.6916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5832 -1.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2971 2.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5987 2.9461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 -0.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5964 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5335 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0761 1.6621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8235 -0.9256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3662 -0.9309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1315 1.6584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6742 1.6531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7296 1.6495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2723 1.6441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0197 -0.9435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5623 -0.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3276 1.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8703 1.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3881 -1.2359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9862 -1.2449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6276 -0.6539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4864 -0.3497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9313 1.2880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2936 1.7329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3832 -1.5497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5790 -2.7539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7832 -1.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0007 2.9551 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 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 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 M CHG 1 44 -1 M END