HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 -4.145 4.962 3.219 0.00 0.00 C+0 HETATM 2 O UNK 0 -3.136 4.524 2.315 0.00 0.00 O+0 HETATM 3 C UNK 0 -3.055 3.172 2.095 0.00 0.00 C+0 HETATM 4 C UNK 0 -3.872 2.197 2.661 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.677 0.852 2.336 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.666 0.476 1.448 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.822 1.437 0.872 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.728 1.060 -0.109 0.00 0.00 C+0 HETATM 9 C UNK 0 -1.226 1.195 -1.540 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.099 0.831 -2.461 0.00 0.00 C+0 HETATM 11 O UNK 0 0.008 1.293 -3.596 0.00 0.00 O+0 HETATM 12 C UNK 0 0.868 -0.180 -1.984 0.00 0.00 C+0 HETATM 13 C UNK 0 1.918 -0.629 -2.800 0.00 0.00 C+0 HETATM 14 O UNK 0 2.109 -0.123 -4.062 0.00 0.00 O+0 HETATM 15 C UNK 0 2.807 -1.615 -2.349 0.00 0.00 C+0 HETATM 16 C UNK 0 3.942 -2.084 -3.219 0.00 0.00 C+0 HETATM 17 C UNK 0 2.600 -2.154 -1.065 0.00 0.00 C+0 HETATM 18 O UNK 0 3.430 -3.117 -0.552 0.00 0.00 O+0 HETATM 19 C UNK 0 1.539 -1.732 -0.242 0.00 0.00 C+0 HETATM 20 C UNK 0 1.364 -2.311 1.138 0.00 0.00 C+0 HETATM 21 C UNK 0 0.695 -0.712 -0.703 0.00 0.00 C+0 HETATM 22 O UNK 0 -0.309 -0.294 0.136 0.00 0.00 O+0 HETATM 23 C UNK 0 -2.044 2.779 1.205 0.00 0.00 C+0 HETATM 24 O UNK 0 -1.250 3.744 0.637 0.00 0.00 O+0 HETATM 25 H UNK 0 -4.077 6.051 3.291 0.00 0.00 H+0 HETATM 26 H UNK 0 -3.983 4.551 4.221 0.00 0.00 H+0 HETATM 27 H UNK 0 -5.144 4.714 2.844 0.00 0.00 H+0 HETATM 28 H UNK 0 -4.669 2.443 3.355 0.00 0.00 H+0 HETATM 29 H UNK 0 -4.317 0.090 2.776 0.00 0.00 H+0 HETATM 30 H UNK 0 -2.540 -0.580 1.212 0.00 0.00 H+0 HETATM 31 H UNK 0 0.143 1.706 0.076 0.00 0.00 H+0 HETATM 32 H UNK 0 -1.537 2.223 -1.754 0.00 0.00 H+0 HETATM 33 H UNK 0 -2.063 0.519 -1.750 0.00 0.00 H+0 HETATM 34 H UNK 0 1.399 0.535 -4.247 0.00 0.00 H+0 HETATM 35 H UNK 0 3.986 -1.569 -4.183 0.00 0.00 H+0 HETATM 36 H UNK 0 4.899 -1.905 -2.717 0.00 0.00 H+0 HETATM 37 H UNK 0 3.836 -3.153 -3.429 0.00 0.00 H+0 HETATM 38 H UNK 0 4.121 -3.340 -1.195 0.00 0.00 H+0 HETATM 39 H UNK 0 1.653 -3.367 1.168 0.00 0.00 H+0 HETATM 40 H UNK 0 1.976 -1.754 1.855 0.00 0.00 H+0 HETATM 41 H UNK 0 0.319 -2.274 1.462 0.00 0.00 H+0 HETATM 42 H UNK 0 -1.573 4.588 1.012 0.00 0.00 H+0 CONECT 1 2 25 26 27 CONECT 2 3 1 CONECT 3 23 4 2 CONECT 4 3 5 28 CONECT 5 4 6 29 CONECT 6 5 7 30 CONECT 7 23 6 8 CONECT 8 22 9 7 31 CONECT 9 10 8 32 33 CONECT 10 12 9 11 CONECT 11 10 CONECT 12 10 13 21 CONECT 13 15 14 12 CONECT 14 13 34 CONECT 15 17 13 16 CONECT 16 15 35 36 37 CONECT 17 15 19 18 CONECT 18 17 38 CONECT 19 17 20 21 CONECT 20 19 39 40 41 CONECT 21 22 19 12 CONECT 22 21 8 CONECT 23 7 3 24 CONECT 24 23 42 CONECT 25 1 CONECT 26 1 CONECT 27 1 CONECT 28 4 CONECT 29 5 CONECT 30 6 CONECT 31 8 CONECT 32 9 CONECT 33 9 CONECT 34 14 CONECT 35 16 CONECT 36 16 CONECT 37 16 CONECT 38 18 CONECT 39 20 CONECT 40 20 CONECT 41 20 CONECT 42 24 MASTER 0 0 0 0 0 0 0 0 42 0 88 0 END