HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 C UNK 0 -4.831 -0.290 -1.498 0.00 0.00 C+0 HETATM 2 O UNK 0 -3.886 -0.260 -2.563 0.00 0.00 O+0 HETATM 3 C UNK 0 -2.768 0.522 -2.322 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.582 0.106 -2.793 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.274 0.838 -2.581 0.00 0.00 C+0 HETATM 6 C UNK 0 0.953 -0.084 -2.434 0.00 0.00 C+0 HETATM 7 C UNK 0 0.763 -1.004 -1.210 0.00 0.00 C+0 HETATM 8 C UNK 0 0.178 -0.333 0.013 0.00 0.00 C+0 HETATM 9 C UNK 0 0.149 -1.078 1.206 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.336 -0.527 2.391 0.00 0.00 C+0 HETATM 11 C UNK 0 -0.780 0.788 2.400 0.00 0.00 C+0 HETATM 12 O UNK 0 -1.246 1.473 3.495 0.00 0.00 O+0 HETATM 13 C UNK 0 -1.325 0.747 4.717 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.756 1.530 1.205 0.00 0.00 C+0 HETATM 15 O UNK 0 -1.135 2.845 1.279 0.00 0.00 O+0 HETATM 16 C UNK 0 -0.329 0.987 -0.018 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.321 1.785 -1.345 0.00 0.00 C+0 HETATM 18 C UNK 0 0.971 2.638 -1.377 0.00 0.00 C+0 HETATM 19 C UNK 0 2.239 1.774 -1.416 0.00 0.00 C+0 HETATM 20 N UNK 0 2.178 0.753 -2.469 0.00 0.00 N+0 HETATM 21 C UNK 0 3.410 -0.029 -2.513 0.00 0.00 C+0 HETATM 22 C UNK 0 -1.559 2.681 -1.570 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.836 1.865 -1.634 0.00 0.00 C+0 HETATM 24 O UNK 0 -3.901 2.327 -1.224 0.00 0.00 O+0 HETATM 25 H UNK 0 -5.420 -1.206 -1.604 0.00 0.00 H+0 HETATM 26 H UNK 0 -4.346 -0.316 -0.517 0.00 0.00 H+0 HETATM 27 H UNK 0 -5.523 0.554 -1.576 0.00 0.00 H+0 HETATM 28 H UNK 0 -1.550 -0.819 -3.363 0.00 0.00 H+0 HETATM 29 H UNK 0 -0.128 1.435 -3.495 0.00 0.00 H+0 HETATM 30 H UNK 0 0.996 -0.731 -3.322 0.00 0.00 H+0 HETATM 31 H UNK 0 1.710 -1.486 -0.943 0.00 0.00 H+0 HETATM 32 H UNK 0 0.081 -1.818 -1.490 0.00 0.00 H+0 HETATM 33 H UNK 0 0.520 -2.102 1.216 0.00 0.00 H+0 HETATM 34 H UNK 0 -0.333 -1.143 3.283 0.00 0.00 H+0 HETATM 35 H UNK 0 -0.333 0.428 5.050 0.00 0.00 H+0 HETATM 36 H UNK 0 -1.732 1.419 5.479 0.00 0.00 H+0 HETATM 37 H UNK 0 -2.007 -0.105 4.627 0.00 0.00 H+0 HETATM 38 H UNK 0 -1.428 2.979 2.202 0.00 0.00 H+0 HETATM 39 H UNK 0 1.020 3.311 -0.512 0.00 0.00 H+0 HETATM 40 H UNK 0 0.962 3.283 -2.267 0.00 0.00 H+0 HETATM 41 H UNK 0 2.421 1.321 -0.434 0.00 0.00 H+0 HETATM 42 H UNK 0 3.090 2.441 -1.607 0.00 0.00 H+0 HETATM 43 H UNK 0 3.619 -0.545 -1.570 0.00 0.00 H+0 HETATM 44 H UNK 0 4.263 0.623 -2.734 0.00 0.00 H+0 HETATM 45 H UNK 0 3.372 -0.773 -3.316 0.00 0.00 H+0 HETATM 46 H UNK 0 -1.477 3.216 -2.526 0.00 0.00 H+0 HETATM 47 H UNK 0 -1.670 3.460 -0.813 0.00 0.00 H+0 CONECT 1 2 25 26 27 CONECT 2 3 1 CONECT 3 23 4 2 CONECT 4 5 3 28 CONECT 5 4 6 17 29 CONECT 6 5 7 20 30 CONECT 7 8 6 31 32 CONECT 8 9 7 16 CONECT 9 8 10 33 CONECT 10 9 11 34 CONECT 11 14 12 10 CONECT 12 11 13 CONECT 13 12 35 36 37 CONECT 14 11 15 16 CONECT 15 14 38 CONECT 16 17 8 14 CONECT 17 22 16 5 18 CONECT 18 17 19 39 40 CONECT 19 20 18 41 42 CONECT 20 6 19 21 CONECT 21 20 43 44 45 CONECT 22 17 23 46 47 CONECT 23 22 3 24 CONECT 24 23 CONECT 25 1 CONECT 26 1 CONECT 27 1 CONECT 28 4 CONECT 29 5 CONECT 30 6 CONECT 31 7 CONECT 32 7 CONECT 33 9 CONECT 34 10 CONECT 35 13 CONECT 36 13 CONECT 37 13 CONECT 38 15 CONECT 39 18 CONECT 40 18 CONECT 41 19 CONECT 42 19 CONECT 43 21 CONECT 44 21 CONECT 45 21 CONECT 46 22 CONECT 47 22 MASTER 0 0 0 0 0 0 0 0 47 0 100 0 END