HEADER REMARK CoA_3312 HETATM 1 S 1 -1.270 7.776 -9.547 S HETATM 2 P 1 -1.469 -3.908 -1.301 P HETATM 3 P 1 -1.555 -4.152 1.447 P HETATM 4 P 1 0.146 -2.444 7.887 P HETATM 5 O 1 -0.742 -3.545 0.141 O HETATM 6 O 1 -0.514 -3.335 -2.412 O HETATM 7 O 1 -0.676 -3.694 2.688 O HETATM 8 O 1 0.405 -1.351 6.738 O HETATM 9 O 1 -2.747 -2.943 -1.334 O HETATM 10 O 1 -1.266 -5.713 1.381 O HETATM 11 O 1 1.348 -2.123 8.906 O HETATM 12 O 1 -1.149 -1.827 8.621 O HETATM 13 O 1 2.382 -0.397 -1.730 O HETATM 14 O 1 -0.145 1.121 5.772 O HETATM 15 O 1 0.983 -1.652 3.788 O HETATM 16 O 1 -1.739 -5.368 -1.364 O HETATM 17 O 1 -2.964 -3.675 1.416 O HETATM 18 O 1 0.030 -3.856 7.456 O HETATM 19 O 1 1.454 2.002 -2.840 O HETATM 20 O 1 1.579 4.399 -7.608 O HETATM 21 N 1 2.024 1.194 -4.874 N HETATM 22 N 1 -0.278 5.173 -6.546 N HETATM 23 N 1 0.916 3.703 -0.529 N HETATM 24 N 1 0.998 0.448 2.769 N HETATM 25 N 1 1.316 0.839 0.579 N HETATM 26 N 1 0.419 4.286 1.661 N HETATM 27 N 1 0.408 2.716 3.491 N HETATM 28 C 1 0.393 -1.117 -3.041 C HETATM 29 C 1 1.791 -0.397 -3.003 C HETATM 30 C 1 -1.111 6.161 -8.666 C HETATM 31 C 1 0.616 -2.423 -2.255 C HETATM 32 C 1 -0.378 6.392 -7.338 C HETATM 33 C 1 2.030 2.497 -5.532 C HETATM 34 C 1 -1.207 -2.724 3.625 C HETATM 35 C 1 0.623 2.989 -5.900 C HETATM 36 C 1 -0.711 -0.277 -2.372 C HETATM 37 C 1 0.004 -1.442 -4.495 C HETATM 38 C 1 0.992 -0.266 4.052 C HETATM 39 C 1 -0.061 -2.308 4.538 C HETATM 40 C 1 -0.268 0.048 4.899 C HETATM 41 C 1 -0.489 -1.292 5.612 C HETATM 42 C 1 1.737 1.040 -3.558 C HETATM 43 C 1 0.700 4.245 -6.766 C HETATM 44 C 1 0.769 3.343 0.755 C HETATM 45 C 1 0.766 1.797 2.576 C HETATM 46 C 1 0.965 2.017 1.213 C HETATM 47 C 1 1.334 -0.063 1.535 C HETATM 48 C 1 0.262 3.929 2.938 C HETATM 49 H 1 -1.803 7.278 -10.682 H HETATM 50 H 1 -3.260 -3.076 -0.502 H HETATM 51 H 1 -1.438 -6.025 0.458 H HETATM 52 H 1 2.060 -2.776 8.803 H HETATM 53 H 1 -1.609 -2.510 9.138 H HETATM 54 H 1 1.940 0.255 -1.135 H HETATM 55 H 1 -0.007 1.912 5.199 H HETATM 56 H 1 2.273 0.377 -5.414 H HETATM 57 H 1 -1.004 4.969 -5.874 H HETATM 58 H 1 0.760 4.671 -0.765 H HETATM 59 H 1 1.145 3.034 -1.260 H HETATM 60 H 1 2.468 -0.987 -3.638 H HETATM 61 H 1 -0.534 5.462 -9.275 H HETATM 62 H 1 -2.106 5.744 -8.482 H HETATM 63 H 1 1.476 -2.973 -2.645 H HETATM 64 H 1 0.779 -2.225 -1.197 H HETATM 65 H 1 -0.897 7.147 -6.739 H HETATM 66 H 1 0.636 6.747 -7.536 H HETATM 67 H 1 2.636 2.429 -6.437 H HETATM 68 H 1 2.509 3.213 -4.859 H HETATM 69 H 1 -1.623 -1.873 3.078 H HETATM 70 H 1 -2.003 -3.196 4.209 H HETATM 71 H 1 0.109 2.213 -6.483 H HETATM 72 H 1 0.038 3.155 -4.989 H HETATM 73 H 1 0.771 -2.049 -4.994 H HETATM 74 H 1 -0.426 0.022 -1.359 H HETATM 75 H 1 -1.641 -0.850 -2.311 H HETATM 76 H 1 -0.913 0.635 -2.942 H HETATM 77 H 1 -0.932 -2.006 -4.523 H HETATM 78 H 1 -0.142 -0.526 -5.078 H HETATM 79 H 1 1.894 0.008 4.612 H HETATM 80 H 1 0.369 -3.201 4.996 H HETATM 81 H 1 -1.112 0.177 4.198 H HETATM 82 H 1 -1.522 -1.411 5.952 H HETATM 83 H 1 1.570 -1.109 1.410 H HETATM 84 H 1 -0.025 4.727 3.619 H CONECT 1 30 49 CONECT 2 5 6 9 16 CONECT 3 5 7 10 17 CONECT 4 8 11 12 18 CONECT 5 2 3 CONECT 6 2 31 CONECT 7 3 34 CONECT 8 4 41 CONECT 9 2 50 CONECT 10 3 51 CONECT 11 4 52 CONECT 12 4 53 CONECT 13 29 54 CONECT 14 40 55 CONECT 15 38 39 CONECT 16 2 CONECT 17 3 CONECT 18 4 CONECT 19 42 CONECT 20 43 CONECT 21 33 42 56 CONECT 22 32 43 57 CONECT 23 44 58 59 CONECT 24 38 45 47 CONECT 25 46 47 CONECT 26 44 48 CONECT 27 45 48 CONECT 28 29 31 36 37 CONECT 29 13 28 42 60 CONECT 30 1 32 61 62 CONECT 31 6 28 63 64 CONECT 32 22 30 65 66 CONECT 33 21 35 67 68 CONECT 34 7 39 69 70 CONECT 35 33 43 71 72 CONECT 36 28 74 75 76 CONECT 37 28 73 77 78 CONECT 38 15 24 40 79 CONECT 39 15 34 41 80 CONECT 40 14 38 41 81 CONECT 41 8 39 40 82 CONECT 42 19 21 29 CONECT 43 20 22 35 CONECT 44 23 26 46 CONECT 45 24 27 46 CONECT 46 25 44 45 CONECT 47 24 25 83 CONECT 48 26 27 84 CONECT 49 1 CONECT 50 9 CONECT 51 10 CONECT 52 11 CONECT 53 12 CONECT 54 13 CONECT 55 14 CONECT 56 21 CONECT 57 22 CONECT 58 23 CONECT 59 23 CONECT 60 29 CONECT 61 30 CONECT 62 30 CONECT 63 31 CONECT 64 31 CONECT 65 32 CONECT 66 32 CONECT 67 33 CONECT 68 33 CONECT 69 34 CONECT 70 34 CONECT 71 35 CONECT 72 35 CONECT 73 37 CONECT 74 36 CONECT 75 36 CONECT 76 36 CONECT 77 37 CONECT 78 37 CONECT 79 38 CONECT 80 39 CONECT 81 40 CONECT 82 41 CONECT 83 47 CONECT 84 48 END