MMs01973835 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 1.3052 0.7393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9032 0.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 2.2179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6227 2.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3175 2.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0247 2.9999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 4.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1836 -1.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5011 0.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0641 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 0.6752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4644 0.0538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3831 2.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4772 1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7379 2.4654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2682 2.1656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9677 0.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7069 -0.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1767 -0.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3457 1.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9805 2.0976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5914 1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 -0.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5914 -1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5881 -1.2213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9596 2.8093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6325 4.1785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 4.4900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0469 5.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1629 4.5097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7374 1.6221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2800 1.6094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2099 -1.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0618 -0.8245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3899 2.0677 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 M END