HEADER PROTEIN 17-JUN-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 17-JUN-22 0 HETATM 1 C UNK 0 -9.336 19.250 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 4.001 14.630 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -12.003 19.250 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 5.335 16.940 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -6.668 13.090 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -8.002 24.640 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 8.002 10.780 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.667 15.400 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -10.669 20.020 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 5.335 15.400 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -9.336 17.710 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 2.667 15.400 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -6.668 14.630 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.334 14.630 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -12.003 17.710 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 4.001 17.710 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -9.336 23.870 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 8.002 12.320 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -10.669 16.940 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 2.667 16.940 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -10.669 24.640 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 9.336 13.090 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -12.003 23.870 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 9.336 14.630 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -12.003 22.330 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 8.002 15.400 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -10.669 21.560 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 6.668 14.630 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -8.002 16.940 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 1.334 14.630 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -1.334 13.090 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -5.335 15.400 0.000 0.00 0.00 C+0 HETATM 33 N UNK 0 -8.002 15.400 0.000 0.00 0.00 N+0 HETATM 34 N UNK 0 -0.000 15.400 0.000 0.00 0.00 N+0 HETATM 35 O UNK 0 -5.335 12.320 0.000 0.00 0.00 O+0 HETATM 36 O UNK 0 -8.002 26.180 0.000 0.00 0.00 O+0 HETATM 37 O UNK 0 9.336 10.010 0.000 0.00 0.00 O+0 HETATM 38 O UNK 0 -13.337 16.940 0.000 0.00 0.00 O-1 HETATM 39 O UNK 0 4.001 19.250 0.000 0.00 0.00 O-1 HETATM 40 O UNK 0 -10.669 15.400 0.000 0.00 0.00 O-1 HETATM 41 O UNK 0 1.334 17.710 0.000 0.00 0.00 O-1 HETATM 42 O UNK 0 -10.669 26.180 0.000 0.00 0.00 O+0 HETATM 43 O UNK 0 10.669 12.320 0.000 0.00 0.00 O+0 HETATM 44 O UNK 0 -13.337 24.640 0.000 0.00 0.00 O+0 HETATM 45 O UNK 0 10.669 15.400 0.000 0.00 0.00 O+0 HETATM 46 O UNK 0 -13.337 21.560 0.000 0.00 0.00 O+0 HETATM 47 O UNK 0 8.002 16.940 0.000 0.00 0.00 O+0 HETATM 48 O UNK 0 -6.668 17.710 0.000 0.00 0.00 O-1 HETATM 49 O UNK 0 1.334 13.090 0.000 0.00 0.00 O+0 HETATM 50 O UNK 0 -0.000 12.320 0.000 0.00 0.00 O+0 HETATM 51 O UNK 0 -2.667 12.320 0.000 0.00 0.00 O+0 HETATM 52 O UNK 0 -5.335 16.940 0.000 0.00 0.00 O+0 HETATM 53 O UNK 0 -4.001 14.630 0.000 0.00 0.00 O+0 HETATM 54 O UNK 0 -9.336 22.330 0.000 0.00 0.00 O+0 HETATM 55 O UNK 0 6.668 13.090 0.000 0.00 0.00 O+0 HETATM 56 Fe UNK 0 -14.670 16.170 0.000 0.00 0.00 Fe+3 HETATM 57 H UNK 0 -5.335 13.860 0.000 0.00 0.00 H+0 HETATM 58 H UNK 0 -2.667 13.860 0.000 0.00 0.00 H+0 HETATM 59 H UNK 0 -9.336 25.410 0.000 0.00 0.00 H+0 HETATM 60 H UNK 0 9.336 11.550 0.000 0.00 0.00 H+0 HETATM 61 H UNK 0 -12.003 25.410 0.000 0.00 0.00 H+0 HETATM 62 H UNK 0 10.669 13.860 0.000 0.00 0.00 H+0 HETATM 63 H UNK 0 -10.669 23.100 0.000 0.00 0.00 H+0 HETATM 64 H UNK 0 8.002 13.860 0.000 0.00 0.00 H+0 HETATM 65 H UNK 0 -13.337 23.100 0.000 0.00 0.00 H+0 HETATM 66 H UNK 0 9.336 16.170 0.000 0.00 0.00 H+0 HETATM 67 H UNK 0 -12.003 20.790 0.000 0.00 0.00 H+0 HETATM 68 H UNK 0 6.668 16.170 0.000 0.00 0.00 H+0 CONECT 1 9 11 CONECT 2 10 12 CONECT 3 9 15 CONECT 4 10 16 CONECT 5 13 35 CONECT 6 17 36 CONECT 7 18 37 CONECT 8 14 53 CONECT 9 1 3 27 CONECT 10 2 4 28 CONECT 11 1 19 29 CONECT 12 2 20 30 CONECT 13 5 32 33 57 CONECT 14 8 31 34 58 CONECT 15 3 19 38 CONECT 16 4 20 39 CONECT 17 6 21 54 59 CONECT 18 7 22 55 60 CONECT 19 11 15 40 CONECT 20 12 16 41 CONECT 21 17 23 42 61 CONECT 22 18 24 43 62 CONECT 23 21 25 44 63 CONECT 24 22 26 45 64 CONECT 25 23 27 46 65 CONECT 26 24 28 47 66 CONECT 27 9 25 54 67 CONECT 28 10 26 55 68 CONECT 29 11 33 48 CONECT 30 12 34 49 CONECT 31 14 50 51 CONECT 32 13 52 53 CONECT 33 13 29 CONECT 34 14 30 CONECT 35 5 CONECT 36 6 CONECT 37 7 CONECT 38 15 CONECT 39 16 CONECT 40 19 CONECT 41 20 CONECT 42 21 CONECT 43 22 CONECT 44 23 CONECT 45 24 CONECT 46 25 CONECT 47 26 CONECT 48 29 CONECT 49 30 CONECT 50 31 CONECT 51 31 CONECT 52 32 CONECT 53 8 32 CONECT 54 17 27 CONECT 55 18 28 CONECT 57 13 CONECT 58 14 CONECT 59 17 CONECT 60 18 CONECT 61 21 CONECT 62 22 CONECT 63 23 CONECT 64 24 CONECT 65 25 CONECT 66 26 CONECT 67 27 CONECT 68 28 MASTER 0 0 0 0 0 0 0 0 68 0 140 0 END