HEADER PROTEIN 20-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 20-JUN-21 0 HETATM 1 C UNK 0 -2.057 -2.213 4.303 0.00 0.00 C+0 HETATM 2 C UNK 0 -2.975 -1.137 3.821 0.00 0.00 C+0 HETATM 3 C UNK 0 -2.747 -0.225 2.861 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.503 -0.060 2.028 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.854 1.325 2.182 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.082 1.433 3.497 0.00 0.00 C+0 HETATM 7 C UNK 0 0.039 1.492 0.936 0.00 0.00 C+0 HETATM 8 C UNK 0 0.641 2.895 0.841 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.886 1.176 -0.245 0.00 0.00 C+0 HETATM 10 S UNK 0 0.029 0.860 -1.784 0.00 0.00 S+1 HETATM 11 O UNK 0 0.261 2.325 -2.533 0.00 0.00 O-1 HETATM 12 S UNK 0 -1.931 -0.253 0.243 0.00 0.00 S+1 HETATM 13 O UNK 0 -1.194 -1.643 -0.291 0.00 0.00 O-1 HETATM 14 H UNK 0 -2.515 -3.192 4.131 0.00 0.00 H+0 HETATM 15 H UNK 0 -1.081 -2.207 3.815 0.00 0.00 H+0 HETATM 16 H UNK 0 -1.892 -2.099 5.380 0.00 0.00 H+0 HETATM 17 H UNK 0 -3.943 -1.111 4.322 0.00 0.00 H+0 HETATM 18 H UNK 0 -3.551 0.482 2.656 0.00 0.00 H+0 HETATM 19 H UNK 0 -0.762 -0.839 2.232 0.00 0.00 H+0 HETATM 20 H UNK 0 -1.628 2.106 2.176 0.00 0.00 H+0 HETATM 21 H UNK 0 0.327 2.439 3.635 0.00 0.00 H+0 HETATM 22 H UNK 0 0.750 0.722 3.529 0.00 0.00 H+0 HETATM 23 H UNK 0 -0.732 1.230 4.354 0.00 0.00 H+0 HETATM 24 H UNK 0 0.863 0.766 0.979 0.00 0.00 H+0 HETATM 25 H UNK 0 1.251 3.007 -0.060 0.00 0.00 H+0 HETATM 26 H UNK 0 -0.140 3.663 0.820 0.00 0.00 H+0 HETATM 27 H UNK 0 1.297 3.103 1.692 0.00 0.00 H+0 HETATM 28 H UNK 0 -1.582 2.001 -0.434 0.00 0.00 H+0 HETATM 29 H UNK 0 -0.976 0.369 -2.546 0.00 0.00 H+0 CONECT 1 2 14 15 16 CONECT 2 3 1 17 CONECT 3 2 4 18 CONECT 4 5 12 3 19 CONECT 5 4 6 7 20 CONECT 6 5 21 22 23 CONECT 7 8 9 5 24 CONECT 8 7 25 26 27 CONECT 9 12 10 7 28 CONECT 10 9 11 29 CONECT 11 10 CONECT 12 4 9 13 CONECT 13 12 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 17 2 CONECT 18 3 CONECT 19 4 CONECT 20 5 CONECT 21 6 CONECT 22 6 CONECT 23 6 CONECT 24 7 CONECT 25 8 CONECT 26 8 CONECT 27 8 CONECT 28 9 CONECT 29 10 MASTER 0 0 0 0 0 0 0 0 29 0 58 0 END