MMs02068941 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.3047 -0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0198 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5866 1.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9027 -0.7203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1846 1.5395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5007 -0.7005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5121 -2.2004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0987 -0.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2669 -2.1712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7364 -2.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4765 -1.1672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4643 -0.0602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7650 1.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6427 2.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9434 3.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3664 4.3485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4887 3.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1880 1.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9117 3.8277 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.9046 -3.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 -4.5830 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5268 -3.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5921 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0438 0.5921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5921 -1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5404 -1.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -1.6534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7865 1.5289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5774 2.7197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3866 1.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9119 -1.9202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7849 1.2594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5043 2.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0455 4.6703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6069 5.5241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0859 1.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0764 -3.7040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2841 -5.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5506 -2.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7307 -4.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 36 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 24 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END