| COMPND 6e4c_ligand | |
| HETATM 1 O1 UNL 1 -5.580 1.649 0.004 1.00 0.00 O | |
| HETATM 2 C1 UNL 1 -4.201 1.689 0.088 1.00 0.00 C | |
| HETATM 3 O2 UNL 1 -3.642 2.762 0.336 1.00 0.00 O | |
| HETATM 4 C2 UNL 1 -3.388 0.462 -0.115 1.00 0.00 C | |
| HETATM 5 N1 UNL 1 -2.122 0.499 -0.038 1.00 0.00 N | |
| HETATM 6 C3 UNL 1 -4.132 -0.770 -0.406 1.00 0.00 C | |
| HETATM 7 O3 UNL 1 -5.017 -0.595 -1.478 1.00 0.00 O | |
| HETATM 8 C4 UNL 1 -3.239 -1.904 -0.586 1.00 0.00 C | |
| HETATM 9 O4 UNL 1 -3.657 -3.074 -0.846 1.00 0.00 O | |
| HETATM 10 C5 UNL 1 -1.790 -1.755 -0.476 1.00 0.00 C | |
| HETATM 11 C6 UNL 1 -1.232 -0.593 -0.210 1.00 0.00 C | |
| HETATM 12 C7 UNL 1 0.227 -0.422 -0.095 1.00 0.00 C | |
| HETATM 13 C8 UNL 1 0.742 0.841 0.190 1.00 0.00 C | |
| HETATM 14 C9 UNL 1 -0.133 1.999 0.378 1.00 0.00 C | |
| HETATM 15 C10 UNL 1 2.123 1.010 0.300 1.00 0.00 C | |
| HETATM 16 C11 UNL 1 1.127 -1.444 -0.253 1.00 0.00 C | |
| HETATM 17 C12 UNL 1 2.490 -1.289 -0.148 1.00 0.00 C | |
| HETATM 18 C13 UNL 1 2.991 -0.042 0.133 1.00 0.00 C | |
| HETATM 19 C14 UNL 1 4.443 0.118 0.245 1.00 0.00 C | |
| HETATM 20 N2 UNL 1 5.101 1.273 0.516 1.00 0.00 N | |
| HETATM 21 O5 UNL 1 6.380 1.023 0.535 1.00 0.00 O | |
| HETATM 22 C15 UNL 1 6.584 -0.228 0.291 1.00 0.00 C | |
| HETATM 23 O6 UNL 1 7.731 -0.763 0.245 1.00 0.00 O | |
| HETATM 24 N3 UNL 1 5.386 -0.818 0.106 1.00 0.00 N | |
| HETATM 25 H1 UNL 1 -6.186 2.423 0.269 1.00 0.00 H | |
| HETATM 26 H2 UNL 1 -4.756 -1.014 0.515 1.00 0.00 H | |
| HETATM 27 H3 UNL 1 -5.885 -1.012 -1.253 1.00 0.00 H | |
| HETATM 28 H4 UNL 1 -1.136 -2.628 -0.616 1.00 0.00 H | |
| HETATM 29 H5 UNL 1 0.522 2.887 0.644 1.00 0.00 H | |
| HETATM 30 H6 UNL 1 -0.694 2.285 -0.533 1.00 0.00 H | |
| HETATM 31 H7 UNL 1 -0.761 1.868 1.284 1.00 0.00 H | |
| HETATM 32 H8 UNL 1 2.549 1.982 0.521 1.00 0.00 H | |
| HETATM 33 H9 UNL 1 0.766 -2.437 -0.475 1.00 0.00 H | |
| HETATM 34 H10 UNL 1 3.150 -2.154 -0.288 1.00 0.00 H | |
| HETATM 35 H11 UNL 1 5.240 -1.829 -0.107 1.00 0.00 H | |
| CONECT 1 2 25 | |
| CONECT 2 3 3 4 | |
| CONECT 4 5 5 6 | |
| CONECT 5 11 | |
| CONECT 6 7 8 26 | |
| CONECT 7 27 | |
| CONECT 8 9 9 10 | |
| CONECT 10 11 11 28 | |
| CONECT 11 12 | |
| CONECT 12 13 13 16 | |
| CONECT 13 14 15 | |
| CONECT 14 29 30 31 | |
| CONECT 15 18 18 32 | |
| CONECT 16 17 17 33 | |
| CONECT 17 18 34 | |
| CONECT 18 19 | |
| CONECT 19 20 20 24 | |
| CONECT 20 21 | |
| CONECT 21 22 | |
| CONECT 22 23 23 24 | |
| CONECT 24 35 | |
| END | |