HEADER PROTEIN 14-JAN-20 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 14-JAN-20 0 HETATM 1 C UNK 0 -6.006 5.001 0.000 0.00 0.00 C+0 HETATM 2 N UNK 0 -6.006 3.457 0.000 0.00 0.00 N+0 HETATM 3 N UNK 0 -7.341 5.777 0.000 0.00 0.00 N+0 HETATM 4 C UNK 0 -0.667 0.376 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 3.321 2.681 0.000 0.00 0.00 C+0 HETATM 6 N UNK 0 -1.994 1.145 0.000 0.00 0.00 N+0 HETATM 7 N UNK 0 4.656 3.449 0.000 0.00 0.00 N+0 HETATM 8 C UNK 0 1.994 -1.160 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -7.341 2.689 0.000 0.00 0.00 C+0 HETATM 10 N UNK 0 -0.667 -1.160 0.000 0.00 0.00 N+0 HETATM 11 N UNK 0 1.994 0.376 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 -3.345 -5.762 0.000 0.00 0.00 C+0 HETATM 13 N UNK 0 7.333 4.994 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 -8.676 3.449 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 0.667 -1.928 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -3.337 -4.225 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -2.002 -6.538 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 -8.676 5.001 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 3.321 1.145 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -4.671 2.689 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.667 -4.233 0.000 0.00 0.00 C+0 HETATM 22 O UNK 0 -4.671 5.770 0.000 0.00 0.00 O+0 HETATM 23 C UNK 0 -0.660 -5.777 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -2.002 -3.457 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 0.667 -3.465 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -3.345 3.465 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -4.671 1.152 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 8.660 5.762 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -2.002 2.689 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -3.337 0.376 0.000 0.00 0.00 C+0 HETATM 31 O UNK 0 0.667 1.145 0.000 0.00 0.00 O+0 HETATM 32 C UNK 0 5.998 2.681 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 4.664 4.994 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 6.006 5.770 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 7.333 3.457 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 1.994 3.449 0.000 0.00 0.00 O+0 HETATM 37 O UNK 0 3.321 -1.928 0.000 0.00 0.00 O+0 HETATM 38 N UNK 0 11.338 7.306 0.000 0.00 0.00 N+0 HETATM 39 Br UNK 0 -4.664 -3.449 0.000 0.00 0.00 Br+0 HETATM 40 Br UNK 0 -2.018 -8.074 0.000 0.00 0.00 Br+0 HETATM 41 O UNK 0 -4.671 -6.522 0.000 0.00 0.00 O+0 HETATM 42 C UNK 0 9.995 4.986 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 8.652 7.298 0.000 0.00 0.00 C+0 HETATM 44 N UNK 0 9.979 0.376 0.000 0.00 0.00 N+0 HETATM 45 C UNK 0 -10.003 2.689 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 9.995 8.074 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 11.322 5.762 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 4.656 0.376 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 -10.003 5.777 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 8.652 1.145 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 5.983 1.145 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 7.318 0.376 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 -11.338 3.449 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 -11.338 5.001 0.000 0.00 0.00 C+0 CONECT 1 2 3 22 CONECT 2 1 9 20 CONECT 3 1 18 CONECT 4 6 10 31 CONECT 5 19 7 36 CONECT 6 4 30 29 CONECT 7 5 32 33 CONECT 8 15 11 37 CONECT 9 2 14 CONECT 10 4 15 CONECT 11 8 19 CONECT 12 17 41 16 CONECT 13 34 28 35 CONECT 14 9 45 18 CONECT 15 8 10 25 CONECT 16 24 39 12 CONECT 17 12 23 40 CONECT 18 3 49 14 CONECT 19 5 11 48 CONECT 20 2 26 27 CONECT 21 25 23 24 CONECT 22 1 CONECT 23 17 21 CONECT 24 16 21 CONECT 25 21 15 CONECT 26 20 29 CONECT 27 20 30 CONECT 28 13 42 43 CONECT 29 26 6 CONECT 30 6 27 CONECT 31 4 CONECT 32 7 35 CONECT 33 7 34 CONECT 34 13 33 CONECT 35 32 13 CONECT 36 5 CONECT 37 8 CONECT 38 47 46 CONECT 39 16 CONECT 40 17 CONECT 41 12 CONECT 42 28 47 CONECT 43 28 46 CONECT 44 50 CONECT 45 14 53 CONECT 46 43 38 CONECT 47 38 42 CONECT 48 19 51 CONECT 49 18 54 CONECT 50 44 52 CONECT 51 48 52 CONECT 52 50 51 CONECT 53 45 54 CONECT 54 49 53 MASTER 0 0 0 0 0 0 0 0 54 0 118 0 END