MMs01638713 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.5000 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2434 1.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7434 1.3180 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9434 1.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7565 -1.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5131 -2.5753 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2565 -1.2876 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4868 2.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7303 3.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4737 5.2188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9737 5.2264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7302 3.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9868 2.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7433 1.3331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 1.3407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9868 2.6435 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0455 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4868 2.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2303 3.9084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0131 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7566 1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2565 1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0131 2.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2697 3.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7697 3.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0061 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0061 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6999 0.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6618 -2.3299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1303 3.9130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8684 6.2550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5684 6.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9302 3.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4433 1.3407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4539 0.7771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8513 0.2454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2131 2.5768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8749 4.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1749 4.9355 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 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M END