HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 4.353 2.137 -0.938 0.00 0.00 C+0 HETATM 2 O UNK 0 3.762 1.692 0.242 0.00 0.00 O+0 HETATM 3 C UNK 0 3.082 0.477 0.040 0.00 0.00 C+0 HETATM 4 O UNK 0 3.733 -0.461 0.911 0.00 0.00 O+0 HETATM 5 C UNK 0 3.121 -1.728 0.952 0.00 0.00 C+0 HETATM 6 O UNK 0 3.618 -2.704 1.534 0.00 0.00 O+0 HETATM 7 C UNK 0 1.802 -1.803 0.228 0.00 0.00 C+0 HETATM 8 C UNK 0 0.970 -0.643 0.790 0.00 0.00 C+0 HETATM 9 O UNK 0 1.028 -0.757 2.168 0.00 0.00 O+0 HETATM 10 C UNK 0 -0.401 -0.763 0.220 0.00 0.00 C+0 HETATM 11 C UNK 0 -0.249 -0.927 -1.285 0.00 0.00 C+0 HETATM 12 C UNK 0 -1.190 -1.922 0.766 0.00 0.00 C+0 HETATM 13 C UNK 0 -2.470 -2.052 -0.002 0.00 0.00 C+0 HETATM 14 C UNK 0 -3.232 -0.817 -0.207 0.00 0.00 C+0 HETATM 15 C UNK 0 -2.584 0.473 0.045 0.00 0.00 C+0 HETATM 16 C UNK 0 -3.426 1.358 0.978 0.00 0.00 C+0 HETATM 17 C UNK 0 -2.449 1.281 -1.222 0.00 0.00 C+0 HETATM 18 O UNK 0 -3.347 1.365 -2.099 0.00 0.00 O+0 HETATM 19 O UNK 0 -1.198 1.883 -1.226 0.00 0.00 O+0 HETATM 20 C UNK 0 -0.592 1.715 0.017 0.00 0.00 C+0 HETATM 21 C UNK 0 -1.203 0.469 0.561 0.00 0.00 C+0 HETATM 22 C UNK 0 0.894 1.724 -0.024 0.00 0.00 C+0 HETATM 23 O UNK 0 1.414 1.721 1.352 0.00 0.00 O+0 HETATM 24 C UNK 0 1.626 0.620 0.378 0.00 0.00 C+0 HETATM 25 H UNK 0 3.614 2.305 -1.734 0.00 0.00 H+0 HETATM 26 H UNK 0 5.160 1.429 -1.236 0.00 0.00 H+0 HETATM 27 H UNK 0 4.832 3.109 -0.701 0.00 0.00 H+0 HETATM 28 H UNK 0 3.206 0.207 -1.012 0.00 0.00 H+0 HETATM 29 H UNK 0 2.048 -1.635 -0.845 0.00 0.00 H+0 HETATM 30 H UNK 0 1.352 -2.775 0.432 0.00 0.00 H+0 HETATM 31 H UNK 0 0.176 -0.615 2.626 0.00 0.00 H+0 HETATM 32 H UNK 0 0.514 -0.226 -1.682 0.00 0.00 H+0 HETATM 33 H UNK 0 0.135 -1.962 -1.472 0.00 0.00 H+0 HETATM 34 H UNK 0 -1.180 -0.742 -1.832 0.00 0.00 H+0 HETATM 35 H UNK 0 -1.478 -1.691 1.829 0.00 0.00 H+0 HETATM 36 H UNK 0 -0.664 -2.885 0.720 0.00 0.00 H+0 HETATM 37 H UNK 0 -2.203 -2.552 -0.980 0.00 0.00 H+0 HETATM 38 H UNK 0 -3.080 -2.837 0.533 0.00 0.00 H+0 HETATM 39 H UNK 0 -3.628 -0.816 -1.266 0.00 0.00 H+0 HETATM 40 H UNK 0 -4.177 -0.871 0.415 0.00 0.00 H+0 HETATM 41 H UNK 0 -4.284 1.770 0.406 0.00 0.00 H+0 HETATM 42 H UNK 0 -3.824 0.678 1.749 0.00 0.00 H+0 HETATM 43 H UNK 0 -2.793 2.154 1.412 0.00 0.00 H+0 HETATM 44 H UNK 0 -0.916 2.559 0.680 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.206 0.549 1.670 0.00 0.00 H+0 HETATM 46 H UNK 0 1.333 2.512 -0.666 0.00 0.00 H+0 CONECT 1 2 25 26 27 CONECT 2 1 3 CONECT 3 2 4 24 28 CONECT 4 3 5 CONECT 5 4 6 7 CONECT 6 5 CONECT 7 5 8 29 30 CONECT 8 7 9 10 24 CONECT 9 8 31 CONECT 10 8 11 12 21 CONECT 11 10 32 33 34 CONECT 12 10 13 35 36 CONECT 13 12 14 37 38 CONECT 14 13 15 39 40 CONECT 15 14 16 17 21 CONECT 16 15 41 42 43 CONECT 17 15 18 19 CONECT 18 17 CONECT 19 17 20 CONECT 20 19 21 22 44 CONECT 21 20 10 15 45 CONECT 22 20 23 24 46 CONECT 23 22 24 CONECT 24 23 3 8 22 CONECT 25 1 CONECT 26 1 CONECT 27 1 CONECT 28 3 CONECT 29 7 CONECT 30 7 CONECT 31 9 CONECT 32 11 CONECT 33 11 CONECT 34 11 CONECT 35 12 CONECT 36 12 CONECT 37 13 CONECT 38 13 CONECT 39 14 CONECT 40 14 CONECT 41 16 CONECT 42 16 CONECT 43 16 CONECT 44 20 CONECT 45 21 CONECT 46 22 MASTER 0 0 0 0 0 0 0 0 46 0 100 0 END