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 -2.175 1.516 -0.208 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.663 0.150 -0.514 0.00 0.00 C+0 HETATM 3 C UNK 0 -2.842 -0.818 -0.499 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.936 -0.007 -1.832 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.833 1.207 -2.675 0.00 0.00 C+0 HETATM 6 C UNK 0 0.420 1.941 -2.316 0.00 0.00 C+0 HETATM 7 C UNK 0 1.093 1.148 -1.207 0.00 0.00 C+0 HETATM 8 C UNK 0 2.553 0.980 -1.634 0.00 0.00 C+0 HETATM 9 O UNK 0 1.135 1.974 -0.069 0.00 0.00 O+0 HETATM 10 C UNK 0 0.797 1.534 1.200 0.00 0.00 C+0 HETATM 11 C UNK 0 1.237 2.229 2.307 0.00 0.00 C+0 HETATM 12 C UNK 0 0.911 1.806 3.590 0.00 0.00 C+0 HETATM 13 C UNK 0 0.139 0.681 3.767 0.00 0.00 C+0 HETATM 14 O UNK 0 -0.186 0.261 5.060 0.00 0.00 O+0 HETATM 15 C UNK 0 -0.287 0.007 2.645 0.00 0.00 C+0 HETATM 16 C UNK 0 0.022 0.404 1.359 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.431 -0.314 0.167 0.00 0.00 C+0 HETATM 18 C UNK 0 -0.599 -1.774 0.506 0.00 0.00 C+0 HETATM 19 C UNK 0 0.324 -2.666 0.311 0.00 0.00 C+0 HETATM 20 C UNK 0 0.138 -4.070 0.647 0.00 0.00 C+0 HETATM 21 O UNK 0 -0.898 -4.543 1.141 0.00 0.00 O+0 HETATM 22 C UNK 0 1.601 -2.183 -0.279 0.00 0.00 C+0 HETATM 23 C UNK 0 1.175 -1.326 -1.476 0.00 0.00 C+0 HETATM 24 C UNK 0 0.380 -0.125 -1.049 0.00 0.00 C+0 HETATM 25 H UNK 0 -3.161 1.630 -0.705 0.00 0.00 H+0 HETATM 26 H UNK 0 -1.546 2.342 -0.553 0.00 0.00 H+0 HETATM 27 H UNK 0 -2.337 1.597 0.875 0.00 0.00 H+0 HETATM 28 H UNK 0 -3.643 -0.365 -1.122 0.00 0.00 H+0 HETATM 29 H UNK 0 -3.226 -0.940 0.553 0.00 0.00 H+0 HETATM 30 H UNK 0 -2.502 -1.792 -0.918 0.00 0.00 H+0 HETATM 31 H UNK 0 -1.155 -0.957 -2.375 0.00 0.00 H+0 HETATM 32 H UNK 0 -1.755 1.813 -2.552 0.00 0.00 H+0 HETATM 33 H UNK 0 -0.848 0.874 -3.753 0.00 0.00 H+0 HETATM 34 H UNK 0 0.240 3.003 -2.013 0.00 0.00 H+0 HETATM 35 H UNK 0 1.047 2.000 -3.230 0.00 0.00 H+0 HETATM 36 H UNK 0 3.113 0.317 -0.978 0.00 0.00 H+0 HETATM 37 H UNK 0 3.004 2.002 -1.532 0.00 0.00 H+0 HETATM 38 H UNK 0 2.624 0.738 -2.714 0.00 0.00 H+0 HETATM 39 H UNK 0 1.853 3.127 2.175 0.00 0.00 H+0 HETATM 40 H UNK 0 1.255 2.350 4.474 0.00 0.00 H+0 HETATM 41 H UNK 0 0.451 -0.394 5.531 0.00 0.00 H+0 HETATM 42 H UNK 0 -0.893 -0.876 2.809 0.00 0.00 H+0 HETATM 43 H UNK 0 -1.541 -2.084 0.933 0.00 0.00 H+0 HETATM 44 H UNK 0 0.958 -4.770 0.457 0.00 0.00 H+0 HETATM 45 H UNK 0 2.241 -2.988 -0.651 0.00 0.00 H+0 HETATM 46 H UNK 0 2.130 -1.547 0.486 0.00 0.00 H+0 HETATM 47 H UNK 0 0.539 -1.986 -2.104 0.00 0.00 H+0 HETATM 48 H UNK 0 2.078 -1.106 -2.036 0.00 0.00 H+0 CONECT 1 2 25 26 27 CONECT 2 1 3 4 17 CONECT 3 2 28 29 30 CONECT 4 2 5 24 31 CONECT 5 4 6 32 33 CONECT 6 5 7 34 35 CONECT 7 6 8 9 24 CONECT 8 7 36 37 38 CONECT 9 7 10 CONECT 10 9 11 16 CONECT 11 10 12 39 CONECT 12 11 13 40 CONECT 13 12 14 15 CONECT 14 13 41 CONECT 15 13 16 42 CONECT 16 15 17 10 CONECT 17 16 18 2 24 CONECT 18 17 19 43 CONECT 19 18 20 22 CONECT 20 19 21 44 CONECT 21 20 CONECT 22 19 23 45 46 CONECT 23 22 24 47 48 CONECT 24 23 4 7 17 CONECT 25 1 CONECT 26 1 CONECT 27 1 CONECT 28 3 CONECT 29 3 CONECT 30 3 CONECT 31 4 CONECT 32 5 CONECT 33 5 CONECT 34 6 CONECT 35 6 CONECT 36 8 CONECT 37 8 CONECT 38 8 CONECT 39 11 CONECT 40 12 CONECT 41 14 CONECT 42 15 CONECT 43 18 CONECT 44 20 CONECT 45 22 CONECT 46 22 CONECT 47 23 CONECT 48 23 MASTER 0 0 0 0 0 0 0 0 48 0 104 0 END