MMs02949972 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 56 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 0.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 1.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7392 1.3297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7605 -1.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2606 -1.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5212 -2.5857 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 0.0491 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7391 1.3543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9785 2.6471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2391 1.3665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 0.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2390 1.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4784 2.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9784 2.6717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2178 3.9645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9572 5.2697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1965 6.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6966 6.5502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9573 5.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7179 3.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2603 -1.2069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7602 -1.1946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4995 0.1105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5208 -2.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9220 -3.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0449 -4.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3377 -4.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0138 -2.6320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0098 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6308 2.3517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3307 2.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 -2.3026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6083 -0.9852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4082 -0.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4389 1.4009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0698 3.7281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8827 4.5059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8701 6.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 6.9822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9785 7.7425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0317 6.0089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0443 4.4663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9359 2.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5936 3.5326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6688 -2.2510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7503 -4.1218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9292 -6.0517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4379 -4.5757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 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 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 M END