HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 4.689 -3.889 0.510 0.00 0.00 C+0 HETATM 2 C UNK 0 3.662 -2.909 0.013 0.00 0.00 C+0 HETATM 3 C UNK 0 2.947 -3.143 -1.129 0.00 0.00 C+0 HETATM 4 O UNK 0 3.151 -4.314 -1.884 0.00 0.00 O+0 HETATM 5 C UNK 0 2.027 -2.197 -1.513 0.00 0.00 C+0 HETATM 6 C UNK 0 1.830 -1.051 -0.770 0.00 0.00 C+0 HETATM 7 C UNK 0 2.567 -0.844 0.380 0.00 0.00 C+0 HETATM 8 C UNK 0 3.483 -1.749 0.790 0.00 0.00 C+0 HETATM 9 O UNK 0 4.225 -1.565 1.922 0.00 0.00 O+0 HETATM 10 C UNK 0 2.262 0.398 1.087 0.00 0.00 C+0 HETATM 11 O UNK 0 2.521 0.474 2.301 0.00 0.00 O+0 HETATM 12 C UNK 0 1.658 1.551 0.400 0.00 0.00 C+0 HETATM 13 C UNK 0 2.572 1.975 -0.708 0.00 0.00 C+0 HETATM 14 C UNK 0 1.975 3.196 -1.335 0.00 0.00 C+0 HETATM 15 Br UNK 0 2.554 3.302 -3.193 0.00 0.00 Br+0 HETATM 16 C UNK 0 0.482 3.221 -1.209 0.00 0.00 C+0 HETATM 17 C UNK 0 0.134 4.208 -0.107 0.00 0.00 C+0 HETATM 18 C UNK 0 -0.029 3.871 -2.512 0.00 0.00 C+0 HETATM 19 O UNK 0 -0.152 2.034 -1.105 0.00 0.00 O+0 HETATM 20 C UNK 0 0.343 1.053 -0.314 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.582 0.573 0.746 0.00 0.00 C+0 HETATM 22 C UNK 0 -1.940 0.094 0.475 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.278 -1.065 -0.335 0.00 0.00 C+0 HETATM 24 C UNK 0 -2.556 -0.641 -1.801 0.00 0.00 C+0 HETATM 25 C UNK 0 -1.278 -2.187 -0.422 0.00 0.00 C+0 HETATM 26 C UNK 0 -3.581 -1.757 0.072 0.00 0.00 C+0 HETATM 27 Br UNK 0 -3.277 -3.276 1.233 0.00 0.00 Br+0 HETATM 28 C UNK 0 -4.618 -0.840 0.580 0.00 0.00 C+0 HETATM 29 C UNK 0 -4.158 0.191 1.537 0.00 0.00 C+0 HETATM 30 C UNK 0 -2.704 0.228 1.806 0.00 0.00 C+0 HETATM 31 C UNK 0 -2.181 -0.617 2.899 0.00 0.00 C+0 HETATM 32 O UNK 0 -2.422 1.574 2.191 0.00 0.00 O+0 HETATM 33 C UNK 0 0.868 -0.028 -1.164 0.00 0.00 C+0 HETATM 34 O UNK 0 0.481 -0.125 -2.380 0.00 0.00 O+0 HETATM 35 H UNK 0 4.370 -4.932 0.380 0.00 0.00 H+0 HETATM 36 H UNK 0 5.660 -3.748 0.029 0.00 0.00 H+0 HETATM 37 H UNK 0 4.821 -3.747 1.620 0.00 0.00 H+0 HETATM 38 H UNK 0 3.833 -4.990 -1.582 0.00 0.00 H+0 HETATM 39 H UNK 0 1.456 -2.371 -2.415 0.00 0.00 H+0 HETATM 40 H UNK 0 4.191 -0.798 2.515 0.00 0.00 H+0 HETATM 41 H UNK 0 1.425 2.326 1.129 0.00 0.00 H+0 HETATM 42 H UNK 0 2.591 1.181 -1.480 0.00 0.00 H+0 HETATM 43 H UNK 0 3.587 2.217 -0.338 0.00 0.00 H+0 HETATM 44 H UNK 0 2.442 4.091 -0.828 0.00 0.00 H+0 HETATM 45 H UNK 0 1.032 4.581 0.422 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.419 5.096 -0.474 0.00 0.00 H+0 HETATM 47 H UNK 0 -0.518 3.736 0.680 0.00 0.00 H+0 HETATM 48 H UNK 0 0.317 4.910 -2.594 0.00 0.00 H+0 HETATM 49 H UNK 0 -1.121 3.753 -2.525 0.00 0.00 H+0 HETATM 50 H UNK 0 0.358 3.246 -3.348 0.00 0.00 H+0 HETATM 51 H UNK 0 -0.012 -0.176 1.428 0.00 0.00 H+0 HETATM 52 H UNK 0 -0.616 1.460 1.492 0.00 0.00 H+0 HETATM 53 H UNK 0 -2.428 1.009 -0.085 0.00 0.00 H+0 HETATM 54 H UNK 0 -2.018 -1.257 -2.518 0.00 0.00 H+0 HETATM 55 H UNK 0 -3.642 -0.566 -1.992 0.00 0.00 H+0 HETATM 56 H UNK 0 -2.170 0.392 -1.882 0.00 0.00 H+0 HETATM 57 H UNK 0 -1.808 -3.149 -0.262 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.842 -2.295 -1.437 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.530 -2.150 0.397 0.00 0.00 H+0 HETATM 60 H UNK 0 -3.980 -2.237 -0.857 0.00 0.00 H+0 HETATM 61 H UNK 0 -5.399 -1.475 1.089 0.00 0.00 H+0 HETATM 62 H UNK 0 -5.194 -0.342 -0.254 0.00 0.00 H+0 HETATM 63 H UNK 0 -4.676 0.075 2.536 0.00 0.00 H+0 HETATM 64 H UNK 0 -4.497 1.213 1.187 0.00 0.00 H+0 HETATM 65 H UNK 0 -3.027 -1.133 3.412 0.00 0.00 H+0 HETATM 66 H UNK 0 -1.714 -0.019 3.747 0.00 0.00 H+0 HETATM 67 H UNK 0 -1.371 -1.322 2.623 0.00 0.00 H+0 HETATM 68 H UNK 0 -2.776 1.675 3.126 0.00 0.00 H+0 CONECT 1 2 35 36 37 CONECT 2 1 3 8 CONECT 3 2 4 5 CONECT 4 3 38 CONECT 5 3 6 39 CONECT 6 5 7 33 CONECT 7 6 8 10 CONECT 8 7 9 2 CONECT 9 8 40 CONECT 10 7 11 12 CONECT 11 10 CONECT 12 10 13 20 41 CONECT 13 12 14 42 43 CONECT 14 13 15 16 44 CONECT 15 14 CONECT 16 14 17 18 19 CONECT 17 16 45 46 47 CONECT 18 16 48 49 50 CONECT 19 16 20 CONECT 20 19 21 33 12 CONECT 21 20 22 51 52 CONECT 22 21 23 30 53 CONECT 23 22 24 25 26 CONECT 24 23 54 55 56 CONECT 25 23 57 58 59 CONECT 26 23 27 28 60 CONECT 27 26 CONECT 28 26 29 61 62 CONECT 29 28 30 63 64 CONECT 30 29 31 32 22 CONECT 31 30 65 66 67 CONECT 32 30 68 CONECT 33 20 34 6 CONECT 34 33 CONECT 35 1 CONECT 36 1 CONECT 37 1 CONECT 38 4 CONECT 39 5 CONECT 40 9 CONECT 41 12 CONECT 42 13 CONECT 43 13 CONECT 44 14 CONECT 45 17 CONECT 46 17 CONECT 47 17 CONECT 48 18 CONECT 49 18 CONECT 50 18 CONECT 51 21 CONECT 52 21 CONECT 53 22 CONECT 54 24 CONECT 55 24 CONECT 56 24 CONECT 57 25 CONECT 58 25 CONECT 59 25 CONECT 60 26 CONECT 61 28 CONECT 62 28 CONECT 63 29 CONECT 64 29 CONECT 65 31 CONECT 66 31 CONECT 67 31 CONECT 68 32 MASTER 0 0 0 0 0 0 0 0 68 0 142 0 END