D0E3ED AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.834 2.325 0.468 1.00 0.00 C HETATM 2 C UNL 1 0.972 3.610 -0.075 1.00 0.00 C HETATM 3 C UNL 1 2.019 3.908 -0.961 1.00 0.00 C HETATM 4 C UNL 1 2.950 2.926 -1.277 1.00 0.00 C HETATM 5 C UNL 1 2.840 1.652 -0.701 1.00 0.00 C HETATM 6 C UNL 1 1.775 1.350 0.148 1.00 0.00 C HETATM 7 S UNL 1 -0.197 4.868 0.370 1.00 0.00 S HETATM 8 N UNL 1 0.608 5.598 1.653 1.00 0.00 N HETATM 9 O UNL 1 -0.272 5.824 -0.707 1.00 0.00 O HETATM 10 O UNL 1 -1.361 4.230 0.940 1.00 0.00 O HETATM 11 C UNL 1 3.833 0.599 -1.044 1.00 0.00 C HETATM 12 N UNL 1 4.309 -0.207 -0.017 1.00 0.00 N HETATM 13 O UNL 1 4.176 0.482 -2.216 1.00 0.00 O HETATM 14 C UNL 1 5.197 -1.316 -0.311 1.00 0.00 C HETATM 15 C UNL 1 6.437 -1.014 0.510 1.00 0.00 C HETATM 16 C UNL 1 5.872 -0.370 1.780 1.00 0.00 C HETATM 17 C UNL 1 4.550 0.281 1.336 1.00 0.00 C HETATM 18 C UNL 1 7.337 0.071 -0.085 1.00 0.00 C HETATM 19 N UNL 1 7.707 0.939 1.036 1.00 0.00 N HETATM 20 C UNL 1 6.926 0.639 2.213 1.00 0.00 C HETATM 21 C UNL 1 8.590 1.965 0.840 1.00 0.00 C HETATM 22 C UNL 1 9.061 2.925 1.937 1.00 0.00 C HETATM 23 C UNL 1 8.695 2.919 3.422 1.00 0.00 C HETATM 24 C UNL 1 9.517 2.186 4.464 1.00 0.00 C HETATM 25 C UNL 1 10.834 1.768 4.262 1.00 0.00 C HETATM 26 C UNL 1 11.670 1.516 5.363 1.00 0.00 C HETATM 27 C UNL 1 11.200 1.666 6.671 1.00 0.00 C HETATM 28 C UNL 1 9.844 1.882 6.875 1.00 0.00 C HETATM 29 C UNL 1 9.028 2.163 5.782 1.00 0.00 C HETATM 30 F UNL 1 7.751 2.501 6.020 1.00 0.00 F HETATM 31 O UNL 1 12.117 1.538 7.672 1.00 0.00 O HETATM 32 O UNL 1 9.032 2.174 -0.300 1.00 0.00 O HETATM 33 H UNL 1 7.018 -1.917 0.724 1.00 0.00 H HETATM 34 H UNL 1 5.678 -1.105 2.568 1.00 0.00 H HETATM 35 C UNL 1 12.052 2.469 8.757 1.00 0.00 C HETATM 36 F UNL 1 10.971 3.278 8.740 1.00 0.00 F HETATM 37 F UNL 1 12.042 1.778 9.919 1.00 0.00 F HETATM 38 F UNL 1 13.154 3.251 8.743 1.00 0.00 F HETATM 39 H UNL 1 0.001 2.082 1.122 1.00 0.00 H HETATM 40 H UNL 1 2.095 4.897 -1.411 1.00 0.00 H HETATM 41 H UNL 1 3.765 3.143 -1.967 1.00 0.00 H HETATM 42 H UNL 1 1.657 0.342 0.550 1.00 0.00 H HETATM 43 H UNL 1 1.619 5.481 1.627 1.00 0.00 H HETATM 44 H UNL 1 0.185 5.310 2.536 1.00 0.00 H HETATM 45 H UNL 1 5.380 -1.455 -1.378 1.00 0.00 H HETATM 46 H UNL 1 4.701 -2.217 0.077 1.00 0.00 H HETATM 47 H UNL 1 4.582 1.374 1.358 1.00 0.00 H HETATM 48 H UNL 1 3.731 -0.063 1.976 1.00 0.00 H HETATM 49 H UNL 1 6.839 0.678 -0.850 1.00 0.00 H HETATM 50 H UNL 1 8.237 -0.361 -0.539 1.00 0.00 H HETATM 51 H UNL 1 6.461 1.547 2.592 1.00 0.00 H HETATM 52 H UNL 1 7.603 0.217 2.961 1.00 0.00 H HETATM 53 H UNL 1 8.690 3.894 1.567 1.00 0.00 H HETATM 54 H UNL 1 10.151 2.975 1.834 1.00 0.00 H HETATM 55 H UNL 1 8.840 3.969 3.728 1.00 0.00 H HETATM 56 H UNL 1 7.632 2.749 3.586 1.00 0.00 H HETATM 57 H UNL 1 11.262 1.706 3.265 1.00 0.00 H HETATM 58 H UNL 1 12.715 1.264 5.189 1.00 0.00 H HETATM 59 H UNL 1 9.407 1.902 7.868 1.00 0.00 H CONECT 1 2 6 39 CONECT 2 1 3 7 CONECT 3 2 4 40 CONECT 4 3 5 41 CONECT 5 4 6 11 CONECT 6 5 1 42 CONECT 7 2 8 9 10 CONECT 8 7 43 44 CONECT 9 7 CONECT 10 7 CONECT 11 5 12 13 CONECT 12 11 14 17 CONECT 13 11 CONECT 14 12 15 45 46 CONECT 15 14 16 18 33 CONECT 16 15 17 20 34 CONECT 17 16 12 47 48 CONECT 18 15 19 49 50 CONECT 19 18 20 21 CONECT 20 19 16 51 52 CONECT 21 19 22 32 CONECT 22 21 23 53 54 CONECT 23 22 24 55 56 CONECT 24 23 25 29 CONECT 25 24 26 57 CONECT 26 25 27 58 CONECT 27 26 28 31 CONECT 28 27 29 59 CONECT 29 28 24 30 CONECT 30 29 CONECT 31 27 35 CONECT 32 21 CONECT 33 15 CONECT 34 16 CONECT 35 31 36 37 38 CONECT 36 35 CONECT 37 35 CONECT 38 35 CONECT 39 1 CONECT 40 3 CONECT 41 4 CONECT 42 6 CONECT 43 8 CONECT 44 8 CONECT 45 14 CONECT 46 14 CONECT 47 17 CONECT 48 17 CONECT 49 18 CONECT 50 18 CONECT 51 20 CONECT 52 20 CONECT 53 22 CONECT 54 22 CONECT 55 23 CONECT 56 23 CONECT 57 25 CONECT 58 26 CONECT 59 28 MASTER 0 0 0 0 0 0 0 0 59 0 59 0 END M END $$$$