D06BTN AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 5.174 4.250 4.001 1.00 0.00 N HETATM 2 C UNL 1 5.628 5.232 4.748 1.00 0.00 C HETATM 3 C UNL 1 5.641 5.480 6.234 1.00 0.00 C HETATM 4 C UNL 1 5.462 4.454 7.161 1.00 0.00 C HETATM 5 N UNL 1 4.943 3.191 6.817 1.00 0.00 N HETATM 6 C UNL 1 3.963 3.100 5.813 1.00 0.00 C HETATM 7 C UNL 1 4.288 3.239 4.474 1.00 0.00 C HETATM 8 C UNL 1 5.860 6.776 6.742 1.00 0.00 C HETATM 9 C UNL 1 5.876 7.000 8.139 1.00 0.00 C HETATM 10 C UNL 1 6.045 5.931 9.014 1.00 0.00 C HETATM 11 C UNL 1 5.802 4.660 8.513 1.00 0.00 C HETATM 12 N UNL 1 2.704 2.951 6.262 1.00 0.00 N HETATM 13 C UNL 1 1.786 2.806 5.315 1.00 0.00 C HETATM 14 N UNL 1 2.063 2.492 4.048 1.00 0.00 N HETATM 15 C UNL 1 3.366 2.585 3.662 1.00 0.00 C HETATM 16 O UNL 1 5.623 8.279 8.580 1.00 0.00 O HETATM 17 C UNL 1 4.466 8.311 9.443 1.00 0.00 C HETATM 18 O UNL 1 6.308 5.975 10.354 1.00 0.00 O HETATM 19 C UNL 1 7.145 7.028 10.836 1.00 0.00 C HETATM 20 O UNL 1 3.515 2.302 2.324 1.00 0.00 O HETATM 21 C UNL 1 4.350 1.331 1.787 1.00 0.00 C HETATM 22 C UNL 1 3.834 0.708 0.649 1.00 0.00 C HETATM 23 C UNL 1 4.669 0.100 -0.317 1.00 0.00 C HETATM 24 C UNL 1 6.066 0.123 -0.226 1.00 0.00 C HETATM 25 C UNL 1 6.559 0.528 1.028 1.00 0.00 C HETATM 26 C UNL 1 5.702 1.105 2.028 1.00 0.00 C HETATM 27 F UNL 1 6.246 1.442 3.206 1.00 0.00 F HETATM 28 N UNL 1 6.947 -0.168 -1.365 1.00 0.00 N HETATM 29 C UNL 1 6.461 -0.466 -2.665 1.00 0.00 C HETATM 30 O UNL 1 5.285 -0.764 -2.817 1.00 0.00 O HETATM 31 C UNL 1 7.272 -0.455 -3.947 1.00 0.00 C HETATM 32 C UNL 1 6.605 -1.201 -5.086 1.00 0.00 C HETATM 33 N UNL 1 5.556 -0.756 -5.858 1.00 0.00 N HETATM 34 O UNL 1 7.033 -2.333 -5.365 1.00 0.00 O HETATM 35 C UNL 1 4.754 0.389 -5.929 1.00 0.00 C HETATM 36 C UNL 1 4.902 1.553 -5.180 1.00 0.00 C HETATM 37 C UNL 1 4.068 2.661 -5.413 1.00 0.00 C HETATM 38 C UNL 1 3.087 2.603 -6.397 1.00 0.00 C HETATM 39 C UNL 1 2.896 1.448 -7.132 1.00 0.00 C HETATM 40 C UNL 1 3.719 0.342 -6.890 1.00 0.00 C HETATM 41 F UNL 1 2.316 3.672 -6.637 1.00 0.00 F HETATM 42 C UNL 1 8.801 -0.587 -4.093 1.00 0.00 C HETATM 43 C UNL 1 8.167 0.756 -4.216 1.00 0.00 C HETATM 44 H UNL 1 6.114 6.043 4.175 1.00 0.00 H HETATM 45 H UNL 1 4.449 2.840 7.639 1.00 0.00 H HETATM 46 H UNL 1 5.951 7.627 6.073 1.00 0.00 H HETATM 47 H UNL 1 5.794 3.822 9.207 1.00 0.00 H HETATM 48 H UNL 1 0.749 2.954 5.599 1.00 0.00 H HETATM 49 H UNL 1 4.265 9.353 9.708 1.00 0.00 H HETATM 50 H UNL 1 4.624 7.777 10.384 1.00 0.00 H HETATM 51 H UNL 1 3.573 7.904 8.952 1.00 0.00 H HETATM 52 H UNL 1 7.922 6.585 11.468 1.00 0.00 H HETATM 53 H UNL 1 6.551 7.685 11.480 1.00 0.00 H HETATM 54 H UNL 1 7.640 7.616 10.058 1.00 0.00 H HETATM 55 H UNL 1 2.764 0.735 0.449 1.00 0.00 H HETATM 56 H UNL 1 4.146 -0.331 -1.163 1.00 0.00 H HETATM 57 H UNL 1 7.617 0.451 1.265 1.00 0.00 H HETATM 58 H UNL 1 7.940 -0.049 -1.239 1.00 0.00 H HETATM 59 H UNL 1 5.289 -1.501 -6.489 1.00 0.00 H HETATM 60 H UNL 1 5.650 1.643 -4.406 1.00 0.00 H HETATM 61 H UNL 1 4.184 3.576 -4.837 1.00 0.00 H HETATM 62 H UNL 1 2.125 1.410 -7.897 1.00 0.00 H HETATM 63 H UNL 1 3.539 -0.561 -7.472 1.00 0.00 H HETATM 64 H UNL 1 9.194 -0.996 -5.030 1.00 0.00 H HETATM 65 H UNL 1 9.414 -0.851 -3.248 1.00 0.00 H HETATM 66 H UNL 1 8.119 1.220 -5.192 1.00 0.00 H HETATM 67 H UNL 1 8.421 1.445 -3.417 1.00 0.00 H CONECT 1 2 7 CONECT 2 1 3 44 CONECT 3 2 4 8 CONECT 4 3 5 11 CONECT 5 4 6 45 CONECT 6 5 7 12 CONECT 7 6 1 15 CONECT 8 3 9 46 CONECT 9 8 10 16 CONECT 10 9 11 18 CONECT 11 10 4 47 CONECT 12 6 13 CONECT 13 12 14 48 CONECT 14 13 15 CONECT 15 14 7 20 CONECT 16 9 17 CONECT 17 16 49 50 51 CONECT 18 10 19 CONECT 19 18 52 53 54 CONECT 20 15 21 CONECT 21 20 22 26 CONECT 22 21 23 55 CONECT 23 22 24 56 CONECT 24 23 25 28 CONECT 25 24 26 57 CONECT 26 25 21 27 CONECT 27 26 CONECT 28 24 29 58 CONECT 29 28 30 31 CONECT 30 29 CONECT 31 29 32 42 43 CONECT 32 31 33 34 CONECT 33 32 35 59 CONECT 34 32 CONECT 35 33 36 40 CONECT 36 35 37 60 CONECT 37 36 38 61 CONECT 38 37 39 41 CONECT 39 38 40 62 CONECT 40 39 35 63 CONECT 41 38 CONECT 42 31 43 64 65 CONECT 43 42 31 66 67 CONECT 44 2 CONECT 45 5 CONECT 46 8 CONECT 47 11 CONECT 48 13 CONECT 49 17 CONECT 50 17 CONECT 51 17 CONECT 52 19 CONECT 53 19 CONECT 54 19 CONECT 55 22 CONECT 56 23 CONECT 57 25 CONECT 58 28 CONECT 59 33 CONECT 60 36 CONECT 61 37 CONECT 62 39 CONECT 63 40 CONECT 64 42 CONECT 65 42 CONECT 66 43 CONECT 67 43 MASTER 0 0 0 0 0 0 0 0 67 0 67 0 END M END $$$$