MMs01241278 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 37 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 1.4601 -0.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0404 -1.7268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5352 -1.6024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8788 -0.1423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5963 0.6357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 0.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4561 -0.4699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8925 -0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3868 1.3788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7476 -1.2698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8398 -2.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2723 -3.9002 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4236 -1.9695 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.2473 -1.3023 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0252 -0.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3036 1.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5249 -0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2465 -1.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7462 -1.3999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5242 -0.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8025 1.1976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3029 1.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5812 2.5451 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2749 1.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1681 0.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2749 -1.1681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -2.7528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3186 -2.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4133 1.6283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8246 -2.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6241 -2.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3235 -2.4519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7239 -0.1434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4249 2.2236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 M END