HEADER PROTEIN 15-DEC-20 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 15-DEC-20 0 HETATM 1 H UNK 0 -2.015 7.239 0.000 0.00 0.00 H+0 HETATM 2 C UNK 0 -1.201 5.932 0.000 0.00 0.00 C+0 HETATM 3 S UNK 0 -0.037 6.940 0.000 0.00 0.00 S+0 HETATM 4 C UNK 0 1.282 6.145 0.000 0.00 0.00 C+0 HETATM 5 S UNK 0 2.700 6.744 0.000 0.00 0.00 S+0 HETATM 6 C UNK 0 2.891 8.272 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 1.766 9.324 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 2.420 10.719 0.000 0.00 0.00 C+0 HETATM 9 S UNK 0 3.948 10.528 0.000 0.00 0.00 S+1 HETATM 10 O UNK 0 5.000 11.652 0.000 0.00 0.00 O-1 HETATM 11 C UNK 0 4.239 9.016 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 0.932 4.645 0.000 0.00 0.00 C+0 HETATM 13 N UNK 0 -0.602 4.513 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 -2.021 3.914 0.000 0.00 0.00 C+0 HETATM 15 O UNK 0 -2.600 2.487 0.000 0.00 0.00 O+0 HETATM 16 C UNK 0 -2.620 5.333 0.000 0.00 0.00 C+0 HETATM 17 H UNK 0 -2.630 6.873 0.000 0.00 0.00 H+0 HETATM 18 C UNK 0 -4.047 5.912 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -4.258 7.438 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 -5.262 4.967 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 1.941 3.481 0.000 0.00 0.00 C+0 HETATM 22 O UNK 0 1.436 2.025 0.000 0.00 0.00 O+0 HETATM 23 O UNK 0 3.453 3.772 0.000 0.00 0.00 O+0 HETATM 24 C UNK 0 4.461 2.607 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 5.973 2.898 0.000 0.00 0.00 O+0 HETATM 26 C UNK 0 6.981 1.734 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 6.477 0.279 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 8.494 2.025 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 9.502 0.861 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 11.014 1.152 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 8.998 3.481 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 10.510 3.772 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 3 13 16 CONECT 3 2 4 CONECT 4 3 5 12 CONECT 5 4 6 CONECT 6 5 7 11 CONECT 7 6 8 CONECT 8 7 9 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 6 CONECT 12 4 13 21 CONECT 13 12 2 14 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 2 17 18 CONECT 17 16 CONECT 18 16 19 20 CONECT 19 18 CONECT 20 18 CONECT 21 12 22 23 CONECT 22 21 CONECT 23 21 24 CONECT 24 23 25 CONECT 25 24 26 CONECT 26 25 27 28 CONECT 27 26 CONECT 28 26 29 31 CONECT 29 28 30 CONECT 30 29 CONECT 31 28 32 CONECT 32 31 MASTER 0 0 0 0 0 0 0 0 32 0 68 0 END