D0GI4S AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.283 2.371 3.570 1.00 0.00 C HETATM 2 C UNL 1 0.463 1.445 4.548 1.00 0.00 C HETATM 3 C UNL 1 -0.838 0.822 3.954 1.00 0.00 C HETATM 4 N UNL 1 -0.793 -0.186 3.018 1.00 0.00 N HETATM 5 C UNL 1 -1.945 -0.787 2.319 1.00 0.00 C HETATM 6 B UNL 1 -2.600 0.382 1.389 1.00 0.00 B HETATM 7 O UNL 1 -1.737 1.144 0.480 1.00 0.00 O HETATM 8 N UNL 1 2.277 2.601 2.506 1.00 0.00 N HETATM 9 O UNL 1 -1.919 1.263 4.328 1.00 0.00 O HETATM 10 C UNL 1 -2.906 -1.575 3.308 1.00 0.00 C HETATM 11 O UNL 1 -4.001 0.766 1.504 1.00 0.00 O HETATM 12 C UNL 1 -4.081 -2.479 2.754 1.00 0.00 C HETATM 13 C UNL 1 1.839 2.473 1.110 1.00 0.00 C HETATM 14 C UNL 1 2.996 2.179 0.155 1.00 0.00 C HETATM 15 C UNL 1 4.025 3.276 0.291 1.00 0.00 C HETATM 16 C UNL 1 4.582 3.320 1.720 1.00 0.00 C HETATM 17 C UNL 1 3.545 3.028 2.801 1.00 0.00 C HETATM 18 C UNL 1 -3.853 -3.794 1.971 1.00 0.00 C HETATM 19 O UNL 1 -5.107 -4.424 1.999 1.00 0.00 O HETATM 20 C UNL 1 -5.704 -4.123 3.169 1.00 0.00 C HETATM 21 C UNL 1 -5.063 -3.050 3.757 1.00 0.00 C HETATM 22 C UNL 1 -6.806 -4.770 3.798 1.00 0.00 C HETATM 23 C UNL 1 -7.159 -4.329 5.085 1.00 0.00 C HETATM 24 C UNL 1 -6.443 -3.299 5.717 1.00 0.00 C HETATM 25 C UNL 1 -5.400 -2.633 5.047 1.00 0.00 C HETATM 26 C UNL 1 -7.625 -5.892 3.192 1.00 0.00 C HETATM 27 O UNL 1 3.897 3.156 3.969 1.00 0.00 O HETATM 28 H UNL 1 0.504 3.117 3.318 1.00 0.00 H HETATM 29 H UNL 1 1.260 1.371 3.118 1.00 0.00 H HETATM 30 H UNL 1 0.141 2.129 5.366 1.00 0.00 H HETATM 31 H UNL 1 1.077 0.662 5.063 1.00 0.00 H HETATM 32 H UNL 1 0.140 -0.534 2.743 1.00 0.00 H HETATM 33 H UNL 1 -1.543 -1.535 1.601 1.00 0.00 H HETATM 34 H UNL 1 -1.654 2.049 0.888 1.00 0.00 H HETATM 35 H UNL 1 -3.369 -0.802 3.955 1.00 0.00 H HETATM 36 H UNL 1 -2.272 -2.224 3.942 1.00 0.00 H HETATM 37 H UNL 1 -4.022 1.752 1.349 1.00 0.00 H HETATM 38 H UNL 1 -4.692 -1.848 2.071 1.00 0.00 H HETATM 39 H UNL 1 1.325 3.410 0.816 1.00 0.00 H HETATM 40 H UNL 1 1.113 1.650 0.999 1.00 0.00 H HETATM 41 H UNL 1 2.598 2.149 -0.888 1.00 0.00 H HETATM 42 H UNL 1 3.438 1.189 0.389 1.00 0.00 H HETATM 43 H UNL 1 4.866 3.128 -0.432 1.00 0.00 H HETATM 44 H UNL 1 3.535 4.237 0.041 1.00 0.00 H HETATM 45 H UNL 1 5.054 4.323 1.856 1.00 0.00 H HETATM 46 H UNL 1 5.382 2.557 1.838 1.00 0.00 H HETATM 47 H UNL 1 -3.158 -4.434 2.568 1.00 0.00 H HETATM 48 H UNL 1 -3.433 -3.698 0.954 1.00 0.00 H HETATM 49 H UNL 1 -7.979 -4.801 5.619 1.00 0.00 H HETATM 50 H UNL 1 -6.717 -3.006 6.719 1.00 0.00 H HETATM 51 H UNL 1 -4.881 -1.820 5.527 1.00 0.00 H HETATM 52 H UNL 1 -7.119 -6.417 2.359 1.00 0.00 H HETATM 53 H UNL 1 -8.594 -5.479 2.829 1.00 0.00 H HETATM 54 H UNL 1 -7.902 -6.640 3.972 1.00 0.00 H CONECT 1 2 8 28 29 CONECT 2 1 3 30 31 CONECT 3 2 4 9 CONECT 4 3 5 32 CONECT 5 10 6 4 33 CONECT 6 7 11 5 CONECT 7 6 34 CONECT 8 1 13 17 CONECT 9 3 CONECT 10 5 12 35 36 CONECT 11 6 37 CONECT 12 10 18 21 38 CONECT 13 8 14 39 40 CONECT 14 13 15 41 42 CONECT 15 14 16 43 44 CONECT 16 15 17 45 46 CONECT 17 16 8 27 CONECT 18 12 19 47 48 CONECT 19 18 20 CONECT 20 19 21 22 CONECT 21 20 12 25 CONECT 22 20 23 26 CONECT 23 22 24 49 CONECT 24 23 25 50 CONECT 25 24 21 51 CONECT 26 22 52 53 54 CONECT 27 17 CONECT 28 1 CONECT 29 1 CONECT 30 2 CONECT 31 2 CONECT 32 4 CONECT 33 5 CONECT 34 7 CONECT 35 10 CONECT 36 10 CONECT 37 11 CONECT 38 12 CONECT 39 13 CONECT 40 13 CONECT 41 14 CONECT 42 14 CONECT 43 15 CONECT 44 15 CONECT 45 16 CONECT 46 16 CONECT 47 18 CONECT 48 18 CONECT 49 23 CONECT 50 24 CONECT 51 25 CONECT 52 26 CONECT 53 26 CONECT 54 26 MASTER 0 0 0 0 0 0 0 0 54 0 54 0 END M END $$$$