HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 -5.668 5.523 0.761 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.010 4.576 -0.219 0.00 0.00 C+0 HETATM 3 C UNK 0 -4.205 3.588 0.590 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.497 2.581 -0.303 0.00 0.00 C+0 HETATM 5 O UNK 0 -4.501 1.898 -1.031 0.00 0.00 O+0 HETATM 6 C UNK 0 -2.862 1.568 0.616 0.00 0.00 C+0 HETATM 7 C UNK 0 -2.129 0.537 -0.197 0.00 0.00 C+0 HETATM 8 C UNK 0 -3.031 -0.221 -1.153 0.00 0.00 C+0 HETATM 9 C UNK 0 -2.417 -1.569 -1.419 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.311 -2.718 -1.020 0.00 0.00 C+0 HETATM 11 C UNK 0 -4.253 -2.358 0.110 0.00 0.00 C+0 HETATM 12 C UNK 0 -2.562 -3.953 -0.600 0.00 0.00 C+0 HETATM 13 C UNK 0 -1.212 -4.128 -1.197 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.131 -4.516 -0.229 0.00 0.00 C+0 HETATM 15 C UNK 0 0.032 -3.604 0.950 0.00 0.00 C+0 HETATM 16 C UNK 0 1.330 -2.887 0.906 0.00 0.00 C+0 HETATM 17 O UNK 0 2.255 -3.537 0.293 0.00 0.00 O+0 HETATM 18 N UNK 0 1.643 -1.629 1.440 0.00 0.00 N+0 HETATM 19 C UNK 0 2.877 -1.551 2.250 0.00 0.00 C+0 HETATM 20 C UNK 0 0.909 -0.398 1.286 0.00 0.00 C+0 HETATM 21 C UNK 0 1.234 0.316 -0.002 0.00 0.00 C+0 HETATM 22 C UNK 0 2.707 0.617 0.015 0.00 0.00 C+0 HETATM 23 C UNK 0 3.113 1.811 0.570 0.00 0.00 C+0 HETATM 24 C UNK 0 4.429 2.178 0.629 0.00 0.00 C+0 HETATM 25 C UNK 0 5.396 1.303 0.103 0.00 0.00 C+0 HETATM 26 O UNK 0 6.685 1.742 0.202 0.00 0.00 O+0 HETATM 27 C UNK 0 7.891 1.235 -0.186 0.00 0.00 C+0 HETATM 28 C UNK 0 8.004 1.092 -1.671 0.00 0.00 C+0 HETATM 29 O UNK 0 7.843 2.376 -2.224 0.00 0.00 O+0 HETATM 30 C UNK 0 4.979 0.112 -0.450 0.00 0.00 C+0 HETATM 31 C UNK 0 3.632 -0.240 -0.499 0.00 0.00 C+0 HETATM 32 C UNK 0 -0.563 -0.536 1.493 0.00 0.00 C+0 HETATM 33 O UNK 0 -0.846 -0.839 2.710 0.00 0.00 O+0 HETATM 34 O UNK 0 -1.379 -0.348 0.481 0.00 0.00 O+0 HETATM 35 H UNK 0 -6.353 4.953 1.400 0.00 0.00 H+0 HETATM 36 H UNK 0 -6.175 6.371 0.223 0.00 0.00 H+0 HETATM 37 H UNK 0 -4.894 6.016 1.398 0.00 0.00 H+0 HETATM 38 H UNK 0 -5.801 4.090 -0.814 0.00 0.00 H+0 HETATM 39 H UNK 0 -4.342 5.195 -0.862 0.00 0.00 H+0 HETATM 40 H UNK 0 -3.426 4.141 1.143 0.00 0.00 H+0 HETATM 41 H UNK 0 -4.867 3.024 1.260 0.00 0.00 H+0 HETATM 42 H UNK 0 -2.736 3.023 -0.944 0.00 0.00 H+0 HETATM 43 H UNK 0 -5.258 1.800 -0.373 0.00 0.00 H+0 HETATM 44 H UNK 0 -2.155 2.056 1.285 0.00 0.00 H+0 HETATM 45 H UNK 0 -3.644 1.033 1.196 0.00 0.00 H+0 HETATM 46 H UNK 0 -1.463 1.141 -0.890 0.00 0.00 H+0 HETATM 47 H UNK 0 -3.187 0.346 -2.098 0.00 0.00 H+0 HETATM 48 H UNK 0 -4.006 -0.343 -0.634 0.00 0.00 H+0 HETATM 49 H UNK 0 -2.131 -1.636 -2.502 0.00 0.00 H+0 HETATM 50 H UNK 0 -1.493 -1.665 -0.864 0.00 0.00 H+0 HETATM 51 H UNK 0 -3.992 -2.961 -1.891 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.726 -1.732 0.830 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.209 -1.942 -0.262 0.00 0.00 H+0 HETATM 54 H UNK 0 -4.523 -3.301 0.644 0.00 0.00 H+0 HETATM 55 H UNK 0 -3.253 -4.814 -0.850 0.00 0.00 H+0 HETATM 56 H UNK 0 -2.526 -3.995 0.528 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.888 -3.304 -1.885 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.284 -5.013 -1.906 0.00 0.00 H+0 HETATM 59 H UNK 0 0.826 -4.521 -0.796 0.00 0.00 H+0 HETATM 60 H UNK 0 -0.317 -5.570 0.057 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.022 -4.275 1.864 0.00 0.00 H+0 HETATM 62 H UNK 0 -0.845 -2.975 1.016 0.00 0.00 H+0 HETATM 63 H UNK 0 2.687 -1.901 3.301 0.00 0.00 H+0 HETATM 64 H UNK 0 3.223 -0.506 2.356 0.00 0.00 H+0 HETATM 65 H UNK 0 3.672 -2.154 1.785 0.00 0.00 H+0 HETATM 66 H UNK 0 1.231 0.323 2.095 0.00 0.00 H+0 HETATM 67 H UNK 0 0.721 1.285 0.014 0.00 0.00 H+0 HETATM 68 H UNK 0 0.956 -0.298 -0.879 0.00 0.00 H+0 HETATM 69 H UNK 0 2.329 2.474 0.974 0.00 0.00 H+0 HETATM 70 H UNK 0 4.705 3.123 1.073 0.00 0.00 H+0 HETATM 71 H UNK 0 8.703 1.916 0.213 0.00 0.00 H+0 HETATM 72 H UNK 0 8.048 0.241 0.329 0.00 0.00 H+0 HETATM 73 H UNK 0 9.042 0.762 -1.916 0.00 0.00 H+0 HETATM 74 H UNK 0 7.310 0.405 -2.144 0.00 0.00 H+0 HETATM 75 H UNK 0 8.661 2.915 -2.008 0.00 0.00 H+0 HETATM 76 H UNK 0 5.716 -0.579 -0.844 0.00 0.00 H+0 HETATM 77 H UNK 0 3.299 -1.170 -0.930 0.00 0.00 H+0 CONECT 1 2 35 36 37 CONECT 2 1 3 38 39 CONECT 3 2 4 40 41 CONECT 4 3 5 6 42 CONECT 5 4 43 CONECT 6 4 7 44 45 CONECT 7 6 8 34 46 CONECT 8 7 9 47 48 CONECT 9 8 10 49 50 CONECT 10 9 11 12 51 CONECT 11 10 52 53 54 CONECT 12 10 13 55 56 CONECT 13 12 14 57 58 CONECT 14 13 15 59 60 CONECT 15 14 16 61 62 CONECT 16 15 17 18 CONECT 17 16 CONECT 18 16 19 20 CONECT 19 18 63 64 65 CONECT 20 18 21 32 66 CONECT 21 20 22 67 68 CONECT 22 21 23 31 CONECT 23 22 24 69 CONECT 24 23 25 70 CONECT 25 24 26 30 CONECT 26 25 27 CONECT 27 26 28 71 72 CONECT 28 27 29 73 74 CONECT 29 28 75 CONECT 30 25 31 76 CONECT 31 30 22 77 CONECT 32 20 33 34 CONECT 33 32 CONECT 34 32 7 CONECT 35 1 CONECT 36 1 CONECT 37 1 CONECT 38 2 CONECT 39 2 CONECT 40 3 CONECT 41 3 CONECT 42 4 CONECT 43 5 CONECT 44 6 CONECT 45 6 CONECT 46 7 CONECT 47 8 CONECT 48 8 CONECT 49 9 CONECT 50 9 CONECT 51 10 CONECT 52 11 CONECT 53 11 CONECT 54 11 CONECT 55 12 CONECT 56 12 CONECT 57 13 CONECT 58 13 CONECT 59 14 CONECT 60 14 CONECT 61 15 CONECT 62 15 CONECT 63 19 CONECT 64 19 CONECT 65 19 CONECT 66 20 CONECT 67 21 CONECT 68 21 CONECT 69 23 CONECT 70 24 CONECT 71 27 CONECT 72 27 CONECT 73 28 CONECT 74 28 CONECT 75 29 CONECT 76 30 CONECT 77 31 MASTER 0 0 0 0 0 0 0 0 77 0 156 0 END