MMs02736587 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 -0.5085 -1.4112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9849 -1.6764 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6743 -0.5172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6382 -3.0266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1242 -2.8226 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2833 -2.5120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3894 -1.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0672 -0.6378 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1628 -3.9049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7447 -5.3455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6194 -3.5467 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6579 -4.6290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2398 -6.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2784 -7.1519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7350 -6.7937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1530 -5.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1145 -4.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9297 -4.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7205 -5.6234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4305 -4.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3603 -3.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8596 -3.1693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -4.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7772 -5.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 -5.7185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4856 -7.0883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1289 -0.4068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4068 1.1289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1289 0.4068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6739 -1.6158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5047 -2.6112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5419 -1.6807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8425 -0.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9538 -2.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9685 -3.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1630 -5.5401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5314 -7.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2814 -7.8198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7630 -8.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8149 -7.9910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 -6.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2299 -5.8826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8615 -4.3846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6299 -3.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1115 -3.6029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2064 -2.0640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4922 -2.1497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7674 -4.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3547 -6.7382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4279 -7.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0524 -8.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5434 -6.5215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 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 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END