MMs00744913 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 50 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 1.2938 0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8918 0.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4898 0.7950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4794 2.2949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8044 -1.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1086 -2.1869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4024 -1.4280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0879 0.8130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7067 -2.1689 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0005 -1.4100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0900 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3047 -2.1509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5985 -1.3920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 0.1080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9027 -2.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9131 -3.6329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2173 -4.3739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5111 -3.6149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5007 -2.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1965 -1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7945 -1.3560 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 20.8153 -4.3559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8257 -5.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6072 1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -0.6072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6072 -1.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5161 1.6729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0588 1.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8331 -0.9066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3757 -0.8959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1141 1.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6568 1.7016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7694 -2.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 -3.3869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4271 0.6792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0795 2.0130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7150 -3.3689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3130 -3.3509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8780 -4.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2256 -5.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1882 -0.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6257 -5.8642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8340 -7.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0257 -5.8475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END