MMs02654736 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.3877 -0.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7428 -2.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2386 -2.1394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8079 -0.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6641 0.2187 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2653 -0.3966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3015 -1.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8803 -2.9209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7588 -1.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 -2.2108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3738 -3.6504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4100 -4.7350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8674 -4.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9888 -6.1747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2524 -1.8557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2886 -2.9403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6736 -0.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6374 0.6685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0586 2.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5160 2.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5522 1.3786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1310 -0.0610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4555 1.1102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1102 0.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4555 -1.1102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9665 -2.9418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6023 0.7551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2767 -0.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7573 -0.4605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2981 -3.1186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6633 -4.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2585 -5.5835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1514 -5.5459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0333 -4.0959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5833 -3.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8371 -5.8377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6518 -7.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1405 -6.5116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4715 0.3845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2297 2.9758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8530 3.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7181 1.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9599 -0.9287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 M END