D0K2GG AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.193 2.389 -1.641 1.00 0.00 C HETATM 2 C UNL 1 -0.237 3.715 -1.846 1.00 0.00 C HETATM 3 C UNL 1 -0.477 4.609 -3.275 1.00 0.00 C HETATM 4 C UNL 1 -0.621 4.245 -4.735 1.00 0.00 C HETATM 5 C UNL 1 0.269 2.890 -4.262 1.00 0.00 C HETATM 6 C UNL 1 0.713 2.011 -2.842 1.00 0.00 C HETATM 7 N UNL 1 1.324 2.743 -5.245 1.00 0.00 N HETATM 8 C UNL 1 1.261 4.200 -5.680 1.00 0.00 C HETATM 9 C UNL 1 -0.367 5.406 -6.384 1.00 0.00 C HETATM 10 C UNL 1 1.625 6.022 -6.299 1.00 0.00 C HETATM 11 C UNL 1 3.433 5.459 -5.475 1.00 0.00 C HETATM 12 N UNL 1 3.016 4.238 -4.953 1.00 0.00 N HETATM 13 C UNL 1 5.120 5.936 -4.552 1.00 0.00 C HETATM 14 N UNL 1 5.949 4.989 -3.723 1.00 0.00 N HETATM 15 C UNL 1 6.006 3.689 -4.401 1.00 0.00 C HETATM 16 C UNL 1 4.250 3.404 -4.009 1.00 0.00 C HETATM 17 O UNL 1 4.086 2.782 -2.939 1.00 0.00 O HETATM 18 O UNL 1 5.940 6.773 -4.997 1.00 0.00 O HETATM 19 C UNL 1 7.644 3.095 -4.653 1.00 0.00 C HETATM 20 O UNL 1 7.855 1.798 -5.280 1.00 0.00 O HETATM 21 S UNL 1 5.601 3.303 -6.186 1.00 0.00 S HETATM 22 S UNL 1 4.589 4.894 -6.966 1.00 0.00 S HETATM 23 C UNL 1 6.692 5.259 -2.218 1.00 0.00 C HETATM 24 N UNL 1 -1.939 6.068 -7.757 1.00 0.00 N HETATM 25 C UNL 1 -3.603 6.681 -8.738 1.00 0.00 C HETATM 26 C UNL 1 -4.725 7.892 -10.041 1.00 0.00 C HETATM 27 C UNL 1 -3.292 8.333 -9.505 1.00 0.00 C HETATM 28 C UNL 1 -1.871 7.461 -8.838 1.00 0.00 C HETATM 29 C UNL 1 -3.665 9.455 -8.720 1.00 0.00 C HETATM 30 C UNL 1 -2.467 9.973 -8.539 1.00 0.00 C HETATM 31 C UNL 1 -1.764 9.139 -7.713 1.00 0.00 C HETATM 32 C UNL 1 -0.926 8.361 -8.465 1.00 0.00 C HETATM 33 C UNL 1 -6.331 9.040 -11.179 1.00 0.00 C HETATM 34 C UNL 1 -7.608 10.535 -12.407 1.00 0.00 C HETATM 35 N UNL 1 -9.501 11.384 -12.675 1.00 0.00 N HETATM 36 C UNL 1 -8.077 11.125 -14.381 1.00 0.00 C HETATM 37 N UNL 1 -8.598 12.717 -15.181 1.00 0.00 N HETATM 38 C UNL 1 -9.554 13.504 -14.436 1.00 0.00 C HETATM 39 C UNL 1 -10.220 11.963 -14.179 1.00 0.00 C HETATM 40 O UNL 1 -11.318 11.622 -14.685 1.00 0.00 O HETATM 41 O UNL 1 -8.670 10.282 -15.143 1.00 0.00 O HETATM 42 C UNL 1 -10.542 15.058 -14.979 1.00 0.00 C HETATM 43 O UNL 1 -9.767 16.318 -15.057 1.00 0.00 O HETATM 44 S UNL 1 -8.273 14.070 -13.124 1.00 0.00 S HETATM 45 S UNL 1 -6.652 12.474 -12.963 1.00 0.00 S HETATM 46 C UNL 1 -8.378 13.792 -16.538 1.00 0.00 C HETATM 47 C UNL 1 -10.906 12.694 -12.419 1.00 0.00 C HETATM 48 H UNL 1 0.335 1.840 -0.680 1.00 0.00 H HETATM 49 H UNL 1 -0.179 4.304 -0.913 1.00 0.00 H HETATM 50 H UNL 1 0.286 5.408 -3.074 1.00 0.00 H HETATM 51 H UNL 1 1.591 1.289 -2.647 1.00 0.00 H HETATM 52 H UNL 1 2.166 2.627 -4.571 1.00 0.00 H HETATM 53 H UNL 1 1.281 4.786 -4.698 1.00 0.00 H HETATM 54 H UNL 1 1.659 7.019 -5.899 1.00 0.00 H HETATM 55 H UNL 1 2.004 5.731 -7.276 1.00 0.00 H HETATM 56 H UNL 1 8.435 3.152 -3.874 1.00 0.00 H HETATM 57 H UNL 1 8.106 3.780 -5.410 1.00 0.00 H HETATM 58 H UNL 1 7.662 1.088 -4.650 1.00 0.00 H HETATM 59 H UNL 1 7.302 6.185 -2.134 1.00 0.00 H HETATM 60 H UNL 1 7.323 4.457 -1.735 1.00 0.00 H HETATM 61 H UNL 1 5.880 5.407 -1.490 1.00 0.00 H HETATM 62 H UNL 1 -4.260 5.989 -8.180 1.00 0.00 H HETATM 63 H UNL 1 -4.463 9.154 -8.012 1.00 0.00 H HETATM 64 H UNL 1 -2.052 10.197 -9.549 1.00 0.00 H HETATM 65 H UNL 1 -2.412 8.581 -6.970 1.00 0.00 H HETATM 66 H UNL 1 -0.309 8.727 -9.273 1.00 0.00 H HETATM 67 H UNL 1 -7.180 8.843 -10.512 1.00 0.00 H HETATM 68 H UNL 1 -6.395 8.345 -12.032 1.00 0.00 H HETATM 69 H UNL 1 -11.357 15.383 -14.282 1.00 0.00 H HETATM 70 H UNL 1 -11.110 15.112 -15.956 1.00 0.00 H HETATM 71 H UNL 1 -9.209 16.390 -14.266 1.00 0.00 H HETATM 72 H UNL 1 -8.531 13.515 -17.596 1.00 0.00 H HETATM 73 H UNL 1 -7.473 14.371 -16.339 1.00 0.00 H HETATM 74 H UNL 1 -9.087 14.691 -16.560 1.00 0.00 H HETATM 75 H UNL 1 -12.035 12.394 -12.578 1.00 0.00 H HETATM 76 H UNL 1 -11.357 13.327 -13.453 1.00 0.00 H HETATM 77 H UNL 1 -10.763 13.794 -12.146 1.00 0.00 H CONECT 1 2 6 48 CONECT 2 1 3 49 CONECT 3 2 4 50 CONECT 4 3 5 9 CONECT 5 4 6 7 CONECT 6 5 1 51 CONECT 7 5 8 52 CONECT 8 7 9 12 53 CONECT 9 8 10 4 24 CONECT 10 9 11 54 55 CONECT 11 10 12 13 22 CONECT 12 11 8 16 CONECT 13 11 14 18 CONECT 14 13 15 23 CONECT 15 14 16 19 21 CONECT 16 15 12 17 CONECT 17 16 CONECT 18 13 CONECT 19 15 20 56 57 CONECT 20 19 58 CONECT 21 15 22 CONECT 22 21 11 CONECT 23 14 59 60 61 CONECT 24 9 25 28 CONECT 25 24 26 62 CONECT 26 25 27 33 CONECT 27 26 28 29 CONECT 28 27 24 32 CONECT 29 27 30 63 CONECT 30 29 31 64 CONECT 31 30 32 65 CONECT 32 31 28 66 CONECT 33 26 34 67 68 CONECT 34 35 36 45 33 CONECT 35 34 39 47 CONECT 36 34 37 41 CONECT 37 36 38 46 CONECT 38 37 39 42 44 CONECT 39 38 35 40 CONECT 40 39 CONECT 41 36 CONECT 42 38 43 69 70 CONECT 43 42 71 CONECT 44 38 45 CONECT 45 44 34 CONECT 46 37 72 73 74 CONECT 47 35 75 76 77 CONECT 48 1 CONECT 49 2 CONECT 50 3 CONECT 51 6 CONECT 52 7 CONECT 53 8 CONECT 54 10 CONECT 55 10 CONECT 56 19 CONECT 57 19 CONECT 58 20 CONECT 59 23 CONECT 60 23 CONECT 61 23 CONECT 62 25 CONECT 63 29 CONECT 64 30 CONECT 65 31 CONECT 66 32 CONECT 67 33 CONECT 68 33 CONECT 69 42 CONECT 70 42 CONECT 71 43 CONECT 72 46 CONECT 73 46 CONECT 74 46 CONECT 75 47 CONECT 76 47 CONECT 77 47 MASTER 0 0 0 0 0 0 0 0 77 0 77 0 END M END $$$$