MMs01454797 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 1.2946 -0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2859 -2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 -0.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4907 -0.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4819 -2.2880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0887 -0.8032 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4009 1.4392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7043 2.1816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9989 1.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1195 2.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5174 3.7950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0248 3.6469 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.4062 5.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8970 4.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4991 3.4640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6103 2.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2848 -0.8336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6868 -0.8184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6780 -2.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -1.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0859 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2788 -3.4575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4858 -2.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8321 0.9086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3747 0.8995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -1.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6586 -1.6965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2031 1.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0281 0.8782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 0.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3307 5.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7437 6.1549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8203 6.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0631 5.1213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4979 4.1292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3276 2.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2728 1.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6858 1.7233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4780 -2.3113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6710 -3.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8780 -2.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 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 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 M END