D0C2MH AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.146 0.484 0.204 1.00 0.00 C HETATM 2 C UNL 1 1.174 -0.297 -0.682 1.00 0.00 C HETATM 3 C UNL 1 1.583 -1.051 -1.894 1.00 0.00 C HETATM 4 C UNL 1 2.919 -1.022 -2.127 1.00 0.00 C HETATM 5 C UNL 1 3.857 -0.226 -1.176 1.00 0.00 C HETATM 6 C UNL 1 3.570 0.580 -0.024 1.00 0.00 C HETATM 7 C UNL 1 0.775 -1.942 -2.828 1.00 0.00 C HETATM 8 C UNL 1 1.242 -2.441 -4.103 1.00 0.00 C HETATM 9 C UNL 1 2.600 -2.383 -4.349 1.00 0.00 C HETATM 10 C UNL 1 3.372 -1.700 -3.319 1.00 0.00 C HETATM 11 C UNL 1 4.823 1.171 1.025 1.00 0.00 C HETATM 12 C UNL 1 3.397 -3.048 -5.586 1.00 0.00 C HETATM 13 O UNL 1 2.884 -4.069 -6.013 1.00 0.00 O HETATM 14 N UNL 1 4.548 -2.523 -6.145 1.00 0.00 N HETATM 15 CA UNL 1 5.454 -3.111 -7.443 1.00 0.00 C HETATM 16 C UNL 1 4.410 -3.828 -8.329 1.00 0.00 C HETATM 17 O UNL 1 4.170 -5.132 -8.103 1.00 0.00 O HETATM 18 OXT UNL 1 3.823 -3.271 -9.258 1.00 0.00 O HETATM 19 N UNL 1 6.247 1.173 1.227 1.00 0.00 N HETATM 20 C UNL 1 6.681 2.048 2.497 1.00 0.00 C HETATM 21 C UNL 1 5.531 2.652 2.857 1.00 0.00 C HETATM 22 S UNL 1 4.154 1.671 2.567 1.00 0.00 S HETATM 23 C UNL 1 7.933 2.435 3.642 1.00 0.00 C HETATM 24 C UNL 1 6.111 -1.766 -7.882 1.00 0.00 C HETATM 25 C UNL 1 8.502 3.463 4.494 1.00 0.00 C HETATM 26 C UNL 1 9.548 3.186 5.525 1.00 0.00 C HETATM 27 C UNL 1 10.284 2.013 5.516 1.00 0.00 C HETATM 28 C UNL 1 9.441 1.022 5.095 1.00 0.00 C HETATM 29 C UNL 1 8.743 1.296 3.863 1.00 0.00 C HETATM 30 C UNL 1 6.907 -2.320 -13.560 1.00 0.00 C HETATM 31 C UNL 1 6.708 -2.182 -12.141 1.00 0.00 C HETATM 32 C UNL 1 6.719 -1.025 -10.752 1.00 0.00 C HETATM 33 C UNL 1 6.436 -0.344 -9.082 1.00 0.00 C HETATM 34 C UNL 1 5.930 -0.581 -7.514 1.00 0.00 C HETATM 35 CL UNL 1 5.881 -3.619 -11.463 1.00 0.00 Cl HETATM 36 CL UNL 1 7.573 0.429 -11.647 1.00 0.00 Cl HETATM 37 H UNL 1 1.671 0.958 1.071 1.00 0.00 H HETATM 38 H UNL 1 0.105 -0.274 -0.416 1.00 0.00 H HETATM 39 H UNL 1 4.905 -0.369 -1.381 1.00 0.00 H HETATM 40 H UNL 1 -0.137 -2.439 -2.465 1.00 0.00 H HETATM 41 H UNL 1 0.554 -2.919 -4.802 1.00 0.00 H HETATM 42 H UNL 1 4.446 -1.751 -3.420 1.00 0.00 H HETATM 43 H UNL 1 4.902 -1.684 -5.715 1.00 0.00 H HETATM 44 HA UNL 1 6.182 -3.811 -7.033 1.00 0.00 H HETATM 45 H UNL 1 4.632 -5.538 -7.358 1.00 0.00 H HETATM 46 H UNL 1 5.425 3.537 3.457 1.00 0.00 H HETATM 47 H UNL 1 8.506 4.535 4.265 1.00 0.00 H HETATM 48 H UNL 1 9.473 3.593 6.536 1.00 0.00 H HETATM 49 H UNL 1 11.262 2.056 5.006 1.00 0.00 H HETATM 50 H UNL 1 8.715 0.780 5.908 1.00 0.00 H HETATM 51 H UNL 1 9.376 1.110 2.990 1.00 0.00 H HETATM 52 H UNL 1 7.050 -2.420 -14.578 1.00 0.00 H HETATM 53 H UNL 1 6.825 0.704 -9.150 1.00 0.00 H HETATM 54 H UNL 1 4.875 -0.220 -7.462 1.00 0.00 H CONECT 1 2 6 37 CONECT 2 1 3 38 CONECT 3 2 4 7 CONECT 4 3 5 10 CONECT 5 4 6 39 CONECT 6 5 1 11 CONECT 7 3 8 40 CONECT 8 7 9 41 CONECT 9 8 10 12 CONECT 10 9 4 42 CONECT 11 6 19 22 CONECT 12 9 13 14 CONECT 13 12 CONECT 14 12 15 43 CONECT 15 14 16 24 44 CONECT 16 15 17 18 CONECT 17 16 45 CONECT 18 16 CONECT 19 11 20 CONECT 20 19 21 23 CONECT 21 20 22 46 CONECT 22 21 11 CONECT 23 20 25 29 CONECT 24 15 30 34 CONECT 25 23 26 47 CONECT 26 25 27 48 CONECT 27 26 28 49 CONECT 28 27 29 50 CONECT 29 28 23 51 CONECT 30 24 31 52 CONECT 31 30 32 35 CONECT 32 31 33 36 CONECT 33 32 34 53 CONECT 34 33 24 54 CONECT 35 31 CONECT 36 32 CONECT 37 1 CONECT 38 2 CONECT 39 5 CONECT 40 7 CONECT 41 8 CONECT 42 10 CONECT 43 14 CONECT 44 15 CONECT 45 17 CONECT 46 21 CONECT 47 25 CONECT 48 26 CONECT 49 27 CONECT 50 28 CONECT 51 29 CONECT 52 30 CONECT 53 33 CONECT 54 34 MASTER 0 0 0 0 0 0 0 0 54 0 54 0 END M END $$$$