HEADER PROTEIN 26-OCT-17 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 26-OCT-17 0 HETATM 1 H UNK 0 -5.886 8.662 0.000 0.00 0.00 H+0 HETATM 2 C UNK 0 -6.229 7.160 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -7.700 6.706 0.000 0.00 0.00 C+0 HETATM 4 H UNK 0 -8.829 7.754 0.000 0.00 0.00 H+0 HETATM 5 C UNK 0 -8.043 5.205 0.000 0.00 0.00 C+0 HETATM 6 H UNK 0 -9.514 4.751 0.000 0.00 0.00 H+0 HETATM 7 C UNK 0 -6.914 4.157 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -5.442 4.611 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -5.100 6.113 0.000 0.00 0.00 C+0 HETATM 10 H UNK 0 -3.628 6.567 0.000 0.00 0.00 H+0 HETATM 11 N UNK 0 -4.170 3.744 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 -4.055 2.208 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -5.184 1.161 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -4.841 -0.341 0.000 0.00 0.00 C+0 HETATM 15 H UNK 0 -5.970 -1.388 0.000 0.00 0.00 H+0 HETATM 16 C UNK 0 -3.369 -0.795 0.000 0.00 0.00 C+0 HETATM 17 H UNK 0 -3.027 -2.296 0.000 0.00 0.00 H+0 HETATM 18 C UNK 0 -2.241 0.253 0.000 0.00 0.00 C+0 HETATM 19 Cl UNK 0 -0.769 -0.201 0.000 0.00 0.00 Cl+0 HETATM 20 C UNK 0 -2.583 1.754 0.000 0.00 0.00 C+0 HETATM 21 H UNK 0 -1.454 2.802 0.000 0.00 0.00 H+0 HETATM 22 C UNK 0 -6.707 1.390 0.000 0.00 0.00 C+0 HETATM 23 H UNK 0 -8.040 0.620 0.000 0.00 0.00 H+0 HETATM 24 H UNK 0 -6.936 -0.133 0.000 0.00 0.00 H+0 HETATM 25 C UNK 0 -7.477 2.724 0.000 0.00 0.00 C+0 HETATM 26 H UNK 0 -8.391 3.963 0.000 0.00 0.00 H+0 HETATM 27 O UNK 0 -9.012 2.609 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 -2.836 4.514 0.000 0.00 0.00 C+0 HETATM 29 H UNK 0 -2.145 5.890 0.000 0.00 0.00 H+0 HETATM 30 H UNK 0 -3.527 5.890 0.000 0.00 0.00 H+0 HETATM 31 C UNK 0 -1.503 3.744 0.000 0.00 0.00 C+0 HETATM 32 H UNK 0 -2.816 2.940 0.000 0.00 0.00 H+0 HETATM 33 H UNK 0 -1.503 5.284 0.000 0.00 0.00 H+0 HETATM 34 C UNK 0 -0.169 4.514 0.000 0.00 0.00 C+0 HETATM 35 H UNK 0 1.011 5.504 0.000 0.00 0.00 H+0 HETATM 36 H UNK 0 0.099 6.030 0.000 0.00 0.00 H+0 HETATM 37 N UNK 0 1.165 3.744 0.000 0.00 0.00 N+0 HETATM 38 C UNK 0 2.498 4.514 0.000 0.00 0.00 C+0 HETATM 39 H UNK 0 2.873 3.020 0.000 0.00 0.00 H+0 HETATM 40 H UNK 0 4.038 4.465 0.000 0.00 0.00 H+0 HETATM 41 H UNK 0 2.967 5.981 0.000 0.00 0.00 H+0 HETATM 42 C UNK 0 1.165 2.204 0.000 0.00 0.00 C+0 HETATM 43 H UNK 0 -0.375 2.204 0.000 0.00 0.00 H+0 HETATM 44 H UNK 0 1.165 0.664 0.000 0.00 0.00 H+0 HETATM 45 H UNK 0 2.705 2.204 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 9 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 7 CONECT 6 5 CONECT 7 5 8 25 CONECT 8 7 9 11 CONECT 9 8 2 10 CONECT 10 9 CONECT 11 8 12 28 CONECT 12 11 13 20 CONECT 13 12 14 22 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 17 18 CONECT 17 16 CONECT 18 16 19 20 CONECT 19 18 CONECT 20 18 12 21 CONECT 21 20 CONECT 22 13 23 24 25 CONECT 23 22 CONECT 24 22 CONECT 25 22 7 26 27 CONECT 26 25 CONECT 27 25 CONECT 28 11 29 30 31 CONECT 29 28 CONECT 30 28 CONECT 31 28 32 33 34 CONECT 32 31 CONECT 33 31 CONECT 34 31 35 36 37 CONECT 35 34 CONECT 36 34 CONECT 37 34 38 42 CONECT 38 37 39 40 41 CONECT 39 38 CONECT 40 38 CONECT 41 38 CONECT 42 37 43 44 45 CONECT 43 42 CONECT 44 42 CONECT 45 42 MASTER 0 0 0 0 0 0 0 0 45 0 94 0 END