D0K2RW AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 4.322 -0.795 1.469 1.00 0.00 N HETATM 2 C UNL 1 1.218 0.775 0.567 1.00 0.00 C HETATM 3 C UNL 1 2.255 0.439 1.418 1.00 0.00 C HETATM 4 C UNL 1 3.005 -0.765 1.150 1.00 0.00 C HETATM 5 N UNL 1 0.326 1.347 1.385 1.00 0.00 N HETATM 6 N UNL 1 0.924 1.854 2.502 1.00 0.00 N HETATM 7 C UNL 1 2.148 1.347 2.539 1.00 0.00 C HETATM 8 N UNL 1 3.136 1.636 3.438 1.00 0.00 N HETATM 9 C UNL 1 3.226 2.416 4.657 1.00 0.00 C HETATM 10 C UNL 1 2.142 2.820 5.438 1.00 0.00 C HETATM 11 C UNL 1 2.328 3.525 6.672 1.00 0.00 C HETATM 12 C UNL 1 3.612 3.825 7.121 1.00 0.00 C HETATM 13 C UNL 1 4.709 3.471 6.348 1.00 0.00 C HETATM 14 C UNL 1 4.498 2.761 5.135 1.00 0.00 C HETATM 15 O UNL 1 2.515 -1.736 0.565 1.00 0.00 O HETATM 16 S UNL 1 3.883 4.784 8.620 1.00 0.00 S HETATM 17 O UNL 1 2.690 5.576 8.849 1.00 0.00 O HETATM 18 C UNL 1 4.059 3.574 9.937 1.00 0.00 C HETATM 19 O UNL 1 5.161 5.472 8.452 1.00 0.00 O HETATM 20 C UNL 1 -1.119 1.633 1.118 1.00 0.00 C HETATM 21 C UNL 1 -2.013 0.626 0.287 1.00 0.00 C HETATM 22 C UNL 1 -2.744 -0.614 0.952 1.00 0.00 C HETATM 23 C UNL 1 -2.611 -0.899 2.473 1.00 0.00 C HETATM 24 C UNL 1 -1.554 0.025 3.049 1.00 0.00 C HETATM 25 C UNL 1 -1.776 1.498 2.541 1.00 0.00 C HETATM 26 C UNL 1 -1.001 3.054 0.282 1.00 0.00 C HETATM 27 C UNL 1 -0.555 3.988 1.396 1.00 0.00 C HETATM 28 N UNL 1 -0.186 4.762 2.320 1.00 0.00 N HETATM 29 N UNL 1 -2.399 -2.347 2.706 1.00 0.00 N HETATM 30 C UNL 1 -2.153 -2.752 4.122 1.00 0.00 C HETATM 31 F UNL 1 2.931 2.829 10.123 1.00 0.00 F HETATM 32 F UNL 1 5.069 2.686 9.714 1.00 0.00 F HETATM 33 C UNL 1 -1.793 -4.239 4.416 1.00 0.00 C HETATM 34 F UNL 1 -1.790 -5.006 3.303 1.00 0.00 F HETATM 35 F UNL 1 -0.556 -4.331 4.966 1.00 0.00 F HETATM 36 F UNL 1 -2.659 -4.795 5.296 1.00 0.00 F HETATM 37 H UNL 1 4.857 0.062 1.615 1.00 0.00 H HETATM 38 H UNL 1 4.820 -1.605 1.158 1.00 0.00 H HETATM 39 H UNL 1 0.967 0.460 -0.445 1.00 0.00 H HETATM 40 H UNL 1 4.081 1.509 3.086 1.00 0.00 H HETATM 41 H UNL 1 1.123 2.608 5.121 1.00 0.00 H HETATM 42 H UNL 1 1.451 3.830 7.238 1.00 0.00 H HETATM 43 H UNL 1 5.720 3.737 6.643 1.00 0.00 H HETATM 44 H UNL 1 5.391 2.513 4.564 1.00 0.00 H HETATM 45 H UNL 1 4.272 4.112 10.861 1.00 0.00 H HETATM 46 H UNL 1 -1.504 0.294 -0.622 1.00 0.00 H HETATM 47 H UNL 1 -2.861 1.235 -0.067 1.00 0.00 H HETATM 48 H UNL 1 -2.480 -1.506 0.370 1.00 0.00 H HETATM 49 H UNL 1 -3.826 -0.502 0.763 1.00 0.00 H HETATM 50 H UNL 1 -3.566 -0.648 2.956 1.00 0.00 H HETATM 51 H UNL 1 -0.582 -0.385 2.745 1.00 0.00 H HETATM 52 H UNL 1 -1.552 0.003 4.143 1.00 0.00 H HETATM 53 H UNL 1 -1.346 2.175 3.287 1.00 0.00 H HETATM 54 H UNL 1 -2.848 1.727 2.514 1.00 0.00 H HETATM 55 H UNL 1 -1.983 3.361 -0.088 1.00 0.00 H HETATM 56 H UNL 1 -0.278 2.998 -0.536 1.00 0.00 H HETATM 57 H UNL 1 -1.641 -2.708 2.124 1.00 0.00 H HETATM 58 H UNL 1 -1.318 -2.167 4.520 1.00 0.00 H HETATM 59 H UNL 1 -3.038 -2.502 4.718 1.00 0.00 H CONECT 1 4 37 38 CONECT 2 3 5 39 CONECT 3 2 4 7 CONECT 4 3 1 15 CONECT 5 2 6 20 CONECT 6 5 7 CONECT 7 6 3 8 CONECT 8 7 9 40 CONECT 9 8 10 14 CONECT 10 9 11 41 CONECT 11 10 12 42 CONECT 12 11 13 16 CONECT 13 12 14 43 CONECT 14 13 9 44 CONECT 15 4 CONECT 16 12 17 18 19 CONECT 17 16 CONECT 18 16 31 32 45 CONECT 19 16 CONECT 20 5 21 25 26 CONECT 21 20 22 46 47 CONECT 22 21 23 48 49 CONECT 23 22 24 29 50 CONECT 24 23 25 51 52 CONECT 25 24 20 53 54 CONECT 26 20 27 55 56 CONECT 27 26 28 CONECT 28 27 CONECT 29 23 30 57 CONECT 30 33 29 58 59 CONECT 31 18 CONECT 32 18 CONECT 33 34 35 36 30 CONECT 34 33 CONECT 35 33 CONECT 36 33 CONECT 37 1 CONECT 38 1 CONECT 39 2 CONECT 40 8 CONECT 41 10 CONECT 42 11 CONECT 43 13 CONECT 44 14 CONECT 45 18 CONECT 46 21 CONECT 47 21 CONECT 48 22 CONECT 49 22 CONECT 50 23 CONECT 51 24 CONECT 52 24 CONECT 53 25 CONECT 54 25 CONECT 55 26 CONECT 56 26 CONECT 57 29 CONECT 58 30 CONECT 59 30 MASTER 0 0 0 0 0 0 0 0 59 0 59 0 END M END $$$$