D0B8IQ AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 8.464 -0.811 4.550 1.00 0.00 N HETATM 2 C UNL 1 8.054 1.466 3.980 1.00 0.00 C HETATM 3 N UNL 1 6.979 1.982 4.360 1.00 0.00 N HETATM 4 C UNL 1 6.321 0.862 4.558 1.00 0.00 C HETATM 5 C UNL 1 6.615 -1.614 3.580 1.00 0.00 C HETATM 6 C UNL 1 7.490 -2.290 4.122 1.00 0.00 C HETATM 7 N UNL 1 6.577 0.811 5.655 1.00 0.00 N HETATM 8 C UNL 1 6.764 -0.125 5.538 1.00 0.00 C HETATM 9 C UNL 1 7.207 -0.297 2.901 1.00 0.00 C HETATM 10 C UNL 1 7.134 -1.392 2.677 1.00 0.00 C HETATM 11 C UNL 1 7.861 0.297 1.990 1.00 0.00 C HETATM 12 N UNL 1 7.521 -0.041 0.755 1.00 0.00 N HETATM 13 O UNL 1 8.982 0.421 2.439 1.00 0.00 O HETATM 14 C UNL 1 8.539 -0.540 -0.399 1.00 0.00 C HETATM 15 C UNL 1 10.750 -0.353 -0.786 1.00 0.00 C HETATM 16 C UNL 1 11.051 0.471 -0.037 1.00 0.00 C HETATM 17 C UNL 1 10.035 1.142 -0.131 1.00 0.00 C HETATM 18 C UNL 1 8.974 0.881 -1.582 1.00 0.00 C HETATM 19 C UNL 1 8.026 0.055 -1.415 1.00 0.00 C HETATM 20 CL UNL 1 6.664 0.282 -2.640 1.00 0.00 Cl HETATM 21 C UNL 1 11.952 0.099 1.181 1.00 0.00 C HETATM 22 N UNL 1 11.692 0.759 2.343 1.00 0.00 N HETATM 23 C UNL 1 12.580 0.948 3.415 1.00 0.00 C HETATM 24 C UNL 1 14.022 2.821 3.425 1.00 0.00 C HETATM 25 C UNL 1 15.624 4.902 3.089 1.00 0.00 C HETATM 26 C UNL 1 16.546 4.334 3.337 1.00 0.00 C HETATM 27 C UNL 1 16.066 3.784 4.332 1.00 0.00 C HETATM 28 C UNL 1 15.822 2.553 3.852 1.00 0.00 C HETATM 29 C UNL 1 14.676 2.357 4.299 1.00 0.00 C HETATM 30 C UNL 1 11.470 0.000 4.655 1.00 0.00 C HETATM 31 N UNL 1 10.835 -1.300 4.220 1.00 0.00 N HETATM 32 O UNL 1 12.903 -0.704 1.125 1.00 0.00 O HETATM 33 O UNL 1 6.872 -0.722 6.602 1.00 0.00 O HETATM 34 XX UNL 1 8.203 1.752 3.294 1.00 0.00 Xx HETATM 35 H UNL 1 7.334 -3.757 3.476 1.00 0.00 H HETATM 36 H UNL 1 7.036 1.443 6.450 1.00 0.00 H HETATM 37 H UNL 1 7.592 -2.288 1.851 1.00 0.00 H HETATM 38 H UNL 1 6.437 -0.238 0.905 1.00 0.00 H HETATM 39 H UNL 1 11.866 -0.145 -1.641 1.00 0.00 H HETATM 40 H UNL 1 9.659 0.884 0.775 1.00 0.00 H HETATM 41 H UNL 1 9.410 0.400 -2.520 1.00 0.00 H HETATM 42 H UNL 1 10.870 1.305 2.527 1.00 0.00 H HETATM 43 H UNL 1 12.991 -0.318 3.519 1.00 0.00 H HETATM 44 H UNL 1 16.219 6.318 3.577 1.00 0.00 H HETATM 45 H UNL 1 17.637 4.536 3.020 1.00 0.00 H HETATM 46 H UNL 1 14.828 4.392 4.822 1.00 0.00 H HETATM 47 H UNL 1 16.133 2.191 2.768 1.00 0.00 H HETATM 48 H UNL 1 13.867 2.278 5.049 1.00 0.00 H HETATM 49 H UNL 1 10.429 0.378 4.826 1.00 0.00 H HETATM 50 H UNL 1 11.825 -0.317 5.713 1.00 0.00 H HETATM 51 H UNL 1 10.254 -1.468 3.376 1.00 0.00 H HETATM 52 H UNL 1 10.865 -2.160 4.795 1.00 0.00 H CONECT 1 2 6 CONECT 2 1 3 34 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 6 10 CONECT 6 5 1 35 CONECT 7 4 8 36 CONECT 8 7 9 33 CONECT 9 8 10 11 CONECT 10 9 5 37 CONECT 11 9 12 13 CONECT 12 11 14 38 CONECT 13 11 CONECT 14 12 15 19 CONECT 15 14 16 39 CONECT 16 15 17 21 CONECT 17 16 18 40 CONECT 18 17 19 41 CONECT 19 18 14 20 CONECT 20 19 CONECT 21 16 22 32 CONECT 22 21 23 42 CONECT 23 22 24 30 43 CONECT 24 23 25 29 CONECT 25 24 26 44 CONECT 26 25 27 45 CONECT 27 26 28 46 CONECT 28 27 29 47 CONECT 29 28 24 48 CONECT 30 23 31 49 50 CONECT 31 30 51 52 CONECT 32 21 CONECT 33 8 CONECT 34 2 CONECT 35 6 CONECT 36 7 CONECT 37 10 CONECT 38 12 CONECT 39 15 CONECT 40 17 CONECT 41 18 CONECT 42 22 CONECT 43 23 CONECT 44 25 CONECT 45 26 CONECT 46 27 CONECT 47 28 CONECT 48 29 CONECT 49 30 CONECT 50 30 CONECT 51 31 CONECT 52 31 MASTER 0 0 0 0 0 0 0 0 52 0 52 0 END $$$$