MMs01038222 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.2956 0.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8937 0.7677 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2029 -1.4764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5053 -2.2205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -1.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 0.7795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0898 0.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0829 2.2913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3786 3.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7516 2.4433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7503 3.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2502 3.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9943 4.8718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2384 6.1674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7385 6.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9944 4.8582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5286 4.5397 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.9825 7.4699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1034 -2.2087 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6047 1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0365 -0.6047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6047 -1.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5201 1.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0628 1.6786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8309 -0.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3736 -0.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5108 -3.4205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 2.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8550 2.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1943 4.8773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1337 7.1971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0245 6.8746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5778 8.5118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9406 8.0652 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 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END