MMs01655053 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -1.3043 -0.7408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5875 1.5183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2832 2.2591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0106 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8812 2.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8706 3.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1855 1.5365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4792 2.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7835 1.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 0.0549 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5003 -0.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0983 -0.6860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1089 -2.1859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 0.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6963 -0.6677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9901 0.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9795 1.5914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2943 -0.6494 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -0.6073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3127 -1.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6414 -0.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2747 3.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 2.0926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7014 3.2095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 3.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1860 2.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9667 1.3548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2781 -1.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7355 -1.6289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0128 0.2366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7935 -1.0939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6142 0.9870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1569 0.9978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7048 -1.8676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3293 -0.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3028 -1.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 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 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END