MMs00095178 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 0.7545 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2545 -1.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -1.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5091 -2.5823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0091 -2.5876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7545 -1.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6404 -2.4859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0654 -2.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0601 -0.5174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0285 0.1914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6319 -0.0588 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2820 -2.8948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1304 -4.3871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6501 -2.2799 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8667 -3.1573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2349 -2.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4515 -3.4199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2999 -4.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5165 -5.7896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8847 -5.1747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0363 -3.6824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8197 -2.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4045 -3.0675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0371 0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 -0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3717 -1.7108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -2.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3964 1.0476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0963 1.0571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1127 -3.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4127 -3.6289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2736 -3.6284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7714 -1.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3562 -1.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2054 -5.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3953 -6.9835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8580 -5.8767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9410 -1.6111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3778 -3.7695 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 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 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 37 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 38 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END