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 -3.454 -2.386 0.030 0.00 0.00 C+0 HETATM 2 O UNK 0 -2.648 -1.434 -0.549 0.00 0.00 O+0 HETATM 3 C UNK 0 -2.276 -0.408 0.324 0.00 0.00 C+0 HETATM 4 C UNK 0 -2.874 0.890 -0.098 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.088 2.110 0.115 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.711 1.962 0.650 0.00 0.00 C+0 HETATM 7 C UNK 0 0.058 3.231 0.387 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.075 0.751 0.003 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.197 0.895 -1.490 0.00 0.00 C+0 HETATM 10 C UNK 0 1.389 0.681 0.359 0.00 0.00 C+0 HETATM 11 C UNK 0 1.932 -0.688 0.173 0.00 0.00 C+0 HETATM 12 C UNK 0 3.063 -1.120 -0.295 0.00 0.00 C+0 HETATM 13 C UNK 0 4.216 -0.303 -0.811 0.00 0.00 C+0 HETATM 14 O UNK 0 5.364 -0.533 -0.086 0.00 0.00 O+0 HETATM 15 C UNK 0 3.065 -2.580 -0.283 0.00 0.00 C+0 HETATM 16 O UNK 0 4.040 -3.308 -0.681 0.00 0.00 O+0 HETATM 17 O UNK 0 1.850 -2.990 0.225 0.00 0.00 O+0 HETATM 18 C UNK 0 1.115 -1.883 0.583 0.00 0.00 C+0 HETATM 19 C UNK 0 -0.212 -1.703 -0.107 0.00 0.00 C+0 HETATM 20 C UNK 0 -0.823 -0.443 0.524 0.00 0.00 C+0 HETATM 21 O UNK 0 -0.499 -0.533 1.895 0.00 0.00 O+0 HETATM 22 H UNK 0 -4.393 -1.882 0.390 0.00 0.00 H+0 HETATM 23 H UNK 0 -3.696 -3.138 -0.726 0.00 0.00 H+0 HETATM 24 H UNK 0 -3.026 -2.840 0.964 0.00 0.00 H+0 HETATM 25 H UNK 0 -2.767 -0.680 1.306 0.00 0.00 H+0 HETATM 26 H UNK 0 -3.895 1.025 0.371 0.00 0.00 H+0 HETATM 27 H UNK 0 -3.118 0.811 -1.195 0.00 0.00 H+0 HETATM 28 H UNK 0 -2.622 2.817 0.821 0.00 0.00 H+0 HETATM 29 H UNK 0 -2.009 2.733 -0.826 0.00 0.00 H+0 HETATM 30 H UNK 0 -0.719 1.749 1.754 0.00 0.00 H+0 HETATM 31 H UNK 0 1.145 3.100 0.365 0.00 0.00 H+0 HETATM 32 H UNK 0 -0.276 3.963 1.179 0.00 0.00 H+0 HETATM 33 H UNK 0 -0.310 3.677 -0.574 0.00 0.00 H+0 HETATM 34 H UNK 0 0.781 0.660 -2.002 0.00 0.00 H+0 HETATM 35 H UNK 0 -0.388 1.964 -1.784 0.00 0.00 H+0 HETATM 36 H UNK 0 -0.923 0.212 -1.932 0.00 0.00 H+0 HETATM 37 H UNK 0 1.924 1.350 -0.342 0.00 0.00 H+0 HETATM 38 H UNK 0 1.602 1.014 1.385 0.00 0.00 H+0 HETATM 39 H UNK 0 3.882 0.741 -0.835 0.00 0.00 H+0 HETATM 40 H UNK 0 4.427 -0.595 -1.864 0.00 0.00 H+0 HETATM 41 H UNK 0 5.327 -0.014 0.744 0.00 0.00 H+0 HETATM 42 H UNK 0 0.912 -1.847 1.681 0.00 0.00 H+0 HETATM 43 H UNK 0 -0.007 -1.436 -1.164 0.00 0.00 H+0 HETATM 44 H UNK 0 -0.868 -2.569 -0.030 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.219 -1.021 2.392 0.00 0.00 H+0 CONECT 1 2 22 23 24 CONECT 2 1 3 CONECT 3 2 4 20 25 CONECT 4 3 5 26 27 CONECT 5 4 6 28 29 CONECT 6 5 7 8 30 CONECT 7 6 31 32 33 CONECT 8 6 9 10 20 CONECT 9 8 34 35 36 CONECT 10 8 11 37 38 CONECT 11 10 12 18 CONECT 12 11 13 15 CONECT 13 12 14 39 40 CONECT 14 13 41 CONECT 15 12 16 17 CONECT 16 15 CONECT 17 15 18 CONECT 18 17 19 11 42 CONECT 19 18 20 43 44 CONECT 20 19 21 3 8 CONECT 21 20 45 CONECT 22 1 CONECT 23 1 CONECT 24 1 CONECT 25 3 CONECT 26 4 CONECT 27 4 CONECT 28 5 CONECT 29 5 CONECT 30 6 CONECT 31 7 CONECT 32 7 CONECT 33 7 CONECT 34 9 CONECT 35 9 CONECT 36 9 CONECT 37 10 CONECT 38 10 CONECT 39 13 CONECT 40 13 CONECT 41 14 CONECT 42 18 CONECT 43 19 CONECT 44 19 CONECT 45 21 MASTER 0 0 0 0 0 0 0 0 45 0 94 0 END