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 -9.336 3.850 0.000 0.00 0.00 H+0 HETATM 2 N UNK 0 -9.336 2.310 0.000 0.00 0.00 N+0 HETATM 3 H UNK 0 -10.669 1.540 0.000 0.00 0.00 H+0 HETATM 4 C UNK 0 -8.002 1.540 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -6.668 2.310 0.000 0.00 0.00 C+0 HETATM 6 Cl UNK 0 -6.668 3.850 0.000 0.00 0.00 Cl+0 HETATM 7 C UNK 0 -5.335 1.540 0.000 0.00 0.00 C+0 HETATM 8 H UNK 0 -4.001 2.310 0.000 0.00 0.00 H+0 HETATM 9 C UNK 0 -5.335 0.000 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -4.001 -0.770 0.000 0.00 0.00 C+0 HETATM 11 O UNK 0 -2.667 0.000 0.000 0.00 0.00 O+0 HETATM 12 N UNK 0 -4.001 -2.310 0.000 0.00 0.00 N+0 HETATM 13 H UNK 0 -5.335 -3.080 0.000 0.00 0.00 H+0 HETATM 14 C UNK 0 -2.667 -3.080 0.000 0.00 0.00 C+0 HETATM 15 H UNK 0 -4.001 -3.850 0.000 0.00 0.00 H+0 HETATM 16 C UNK 0 -1.334 -2.310 0.000 0.00 0.00 C+0 HETATM 17 H UNK 0 -0.643 -0.934 0.000 0.00 0.00 H+0 HETATM 18 H UNK 0 -2.025 -0.934 0.000 0.00 0.00 H+0 HETATM 19 C UNK 0 0.000 -3.080 0.000 0.00 0.00 C+0 HETATM 20 H UNK 0 1.537 -2.990 0.000 0.00 0.00 H+0 HETATM 21 H UNK 0 0.846 -1.793 0.000 0.00 0.00 H+0 HETATM 22 N UNK 0 0.000 -4.620 0.000 0.00 0.00 N+0 HETATM 23 C UNK 0 1.334 -5.390 0.000 0.00 0.00 C+0 HETATM 24 H UNK 0 0.643 -6.766 0.000 0.00 0.00 H+0 HETATM 25 H UNK 0 2.025 -6.766 0.000 0.00 0.00 H+0 HETATM 26 C UNK 0 2.667 -4.620 0.000 0.00 0.00 C+0 HETATM 27 H UNK 0 3.359 -3.244 0.000 0.00 0.00 H+0 HETATM 28 H UNK 0 1.976 -3.244 0.000 0.00 0.00 H+0 HETATM 29 C UNK 0 4.001 -5.390 0.000 0.00 0.00 C+0 HETATM 30 H UNK 0 3.310 -6.766 0.000 0.00 0.00 H+0 HETATM 31 H UNK 0 4.692 -6.766 0.000 0.00 0.00 H+0 HETATM 32 O UNK 0 5.335 -4.620 0.000 0.00 0.00 O+0 HETATM 33 C UNK 0 6.668 -5.390 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 8.002 -4.620 0.000 0.00 0.00 C+0 HETATM 35 O UNK 0 8.002 -3.080 0.000 0.00 0.00 O+0 HETATM 36 C UNK 0 9.336 -5.390 0.000 0.00 0.00 C+0 HETATM 37 H UNK 0 10.669 -4.620 0.000 0.00 0.00 H+0 HETATM 38 C UNK 0 9.336 -6.930 0.000 0.00 0.00 C+0 HETATM 39 F UNK 0 10.669 -7.700 0.000 0.00 0.00 F+0 HETATM 40 C UNK 0 8.002 -7.700 0.000 0.00 0.00 C+0 HETATM 41 H UNK 0 8.002 -9.240 0.000 0.00 0.00 H+0 HETATM 42 C UNK 0 6.668 -6.930 0.000 0.00 0.00 C+0 HETATM 43 H UNK 0 5.335 -7.700 0.000 0.00 0.00 H+0 HETATM 44 C UNK 0 -1.334 -5.390 0.000 0.00 0.00 C+0 HETATM 45 H UNK 0 -2.025 -6.766 0.000 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.643 -6.766 0.000 0.00 0.00 H+0 HETATM 47 C UNK 0 -2.667 -4.620 0.000 0.00 0.00 C+0 HETATM 48 H UNK 0 -2.667 -6.160 0.000 0.00 0.00 H+0 HETATM 49 O UNK 0 -4.001 -5.390 0.000 0.00 0.00 O+0 HETATM 50 C UNK 0 -5.335 -4.620 0.000 0.00 0.00 C+0 HETATM 51 H UNK 0 -6.668 -3.850 0.000 0.00 0.00 H+0 HETATM 52 H UNK 0 -6.668 -5.390 0.000 0.00 0.00 H+0 HETATM 53 H UNK 0 -5.335 -6.160 0.000 0.00 0.00 H+0 HETATM 54 C UNK 0 -6.668 -0.770 0.000 0.00 0.00 C+0 HETATM 55 O UNK 0 -6.668 -2.310 0.000 0.00 0.00 O+0 HETATM 56 C UNK 0 -8.002 -3.080 0.000 0.00 0.00 C+0 HETATM 57 H UNK 0 -8.401 -1.592 0.000 0.00 0.00 H+0 HETATM 58 H UNK 0 -9.542 -3.080 0.000 0.00 0.00 H+0 HETATM 59 H UNK 0 -8.401 -4.568 0.000 0.00 0.00 H+0 HETATM 60 C UNK 0 -8.002 0.000 0.000 0.00 0.00 C+0 HETATM 61 H UNK 0 -9.531 0.188 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 2 5 60 CONECT 5 4 6 7 CONECT 6 5 CONECT 7 5 8 9 CONECT 8 7 CONECT 9 7 10 54 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 14 CONECT 13 12 CONECT 14 12 15 16 47 CONECT 15 14 CONECT 16 14 17 18 19 CONECT 17 16 CONECT 18 16 CONECT 19 16 20 21 22 CONECT 20 19 CONECT 21 19 CONECT 22 19 23 44 CONECT 23 22 24 25 26 CONECT 24 23 CONECT 25 23 CONECT 26 23 27 28 29 CONECT 27 26 CONECT 28 26 CONECT 29 26 30 31 32 CONECT 30 29 CONECT 31 29 CONECT 32 29 33 CONECT 33 32 34 42 CONECT 34 33 35 36 CONECT 35 34 CONECT 36 34 37 38 CONECT 37 36 CONECT 38 36 39 40 CONECT 39 38 CONECT 40 38 41 42 CONECT 41 40 CONECT 42 40 33 43 CONECT 43 42 CONECT 44 22 45 46 47 CONECT 45 44 CONECT 46 44 CONECT 47 44 14 48 49 CONECT 48 47 CONECT 49 47 50 CONECT 50 49 51 52 53 CONECT 51 50 CONECT 52 50 CONECT 53 50 CONECT 54 9 55 60 CONECT 55 54 56 CONECT 56 55 57 58 59 CONECT 57 56 CONECT 58 56 CONECT 59 56 CONECT 60 54 4 61 CONECT 61 60 MASTER 0 0 0 0 0 0 0 0 61 0 126 0 END