D0H4HD AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.188 -2.748 2.325 1.00 0.00 C HETATM 2 C UNL 1 3.249 -3.654 1.601 1.00 0.00 C HETATM 3 C UNL 1 2.786 -3.811 0.164 1.00 0.00 C HETATM 4 C UNL 1 2.389 -2.360 -0.268 1.00 0.00 C HETATM 5 C UNL 1 3.146 -1.232 0.666 1.00 0.00 C HETATM 6 C UNL 1 2.870 -1.432 2.292 1.00 0.00 C HETATM 7 N UNL 1 3.967 -1.586 3.308 1.00 0.00 N HETATM 8 H UNL 1 4.857 -1.170 3.047 1.00 0.00 H HETATM 9 C UNL 1 4.267 -2.414 4.416 1.00 0.00 C HETATM 10 N UNL 1 3.539 -3.323 5.269 1.00 0.00 N HETATM 11 C UNL 1 4.301 -4.188 6.093 1.00 0.00 C HETATM 12 C UNL 1 5.665 -4.251 5.847 1.00 0.00 C HETATM 13 C UNL 1 6.240 -3.144 5.291 1.00 0.00 C HETATM 14 N UNL 1 5.580 -2.244 4.588 1.00 0.00 N HETATM 15 N UNL 1 4.066 -4.881 7.500 1.00 0.00 N HETATM 16 C UNL 1 3.159 -5.502 8.470 1.00 0.00 C HETATM 17 C UNL 1 3.925 -5.480 9.671 1.00 0.00 C HETATM 18 N UNL 1 5.157 -5.024 9.448 1.00 0.00 N HETATM 19 N UNL 1 5.298 -4.990 8.153 1.00 0.00 N HETATM 20 C UNL 1 1.931 -6.221 8.557 1.00 0.00 C HETATM 21 C UNL 1 1.606 -6.885 9.779 1.00 0.00 C HETATM 22 C UNL 1 2.367 -6.784 10.959 1.00 0.00 C HETATM 23 C UNL 1 3.497 -5.993 10.909 1.00 0.00 C HETATM 24 N UNL 1 1.715 -4.803 0.351 1.00 0.00 N HETATM 25 S UNL 1 1.312 -5.981 -0.787 1.00 0.00 S HETATM 26 C UNL 1 -0.158 -5.200 -1.381 1.00 0.00 C HETATM 27 O UNL 1 2.308 -6.042 -1.795 1.00 0.00 O HETATM 28 O UNL 1 0.918 -7.133 0.015 1.00 0.00 O HETATM 29 H UNL 1 1.951 -3.077 3.307 1.00 0.00 H HETATM 30 H UNL 1 1.216 -2.643 1.811 1.00 0.00 H HETATM 31 H UNL 1 3.375 -4.585 2.141 1.00 0.00 H HETATM 32 H UNL 1 4.261 -3.219 1.545 1.00 0.00 H HETATM 33 H UNL 1 3.594 -4.193 -0.468 1.00 0.00 H HETATM 34 H UNL 1 1.299 -2.213 -0.202 1.00 0.00 H HETATM 35 H UNL 1 2.605 -2.207 -1.337 1.00 0.00 H HETATM 36 H UNL 1 2.747 -0.262 0.332 1.00 0.00 H HETATM 37 H UNL 1 4.213 -1.229 0.401 1.00 0.00 H HETATM 38 H UNL 1 2.282 -0.550 2.602 1.00 0.00 H HETATM 39 H UNL 1 6.333 -4.970 6.292 1.00 0.00 H HETATM 40 H UNL 1 7.298 -2.947 5.460 1.00 0.00 H HETATM 41 H UNL 1 1.282 -6.378 7.697 1.00 0.00 H HETATM 42 H UNL 1 0.754 -7.573 9.833 1.00 0.00 H HETATM 43 H UNL 1 2.135 -7.344 11.864 1.00 0.00 H HETATM 44 H UNL 1 4.151 -5.903 11.790 1.00 0.00 H HETATM 45 H UNL 1 1.765 -5.305 1.238 1.00 0.00 H HETATM 46 H UNL 1 0.145 -4.379 -2.036 1.00 0.00 H HETATM 47 H UNL 1 -0.730 -4.813 -0.529 1.00 0.00 H HETATM 48 H UNL 1 -0.750 -5.936 -1.919 1.00 0.00 H CONECT 1 2 6 29 30 CONECT 2 1 3 31 32 CONECT 3 2 4 24 33 CONECT 4 3 5 34 35 CONECT 5 4 6 36 37 CONECT 6 5 1 7 38 CONECT 7 8 9 6 CONECT 8 7 CONECT 9 7 10 14 CONECT 10 9 11 CONECT 11 10 12 15 CONECT 12 11 13 39 CONECT 13 12 14 40 CONECT 14 13 9 CONECT 15 11 16 19 CONECT 16 15 17 20 CONECT 17 16 18 23 CONECT 18 17 19 CONECT 19 18 15 CONECT 20 16 21 41 CONECT 21 20 22 42 CONECT 22 21 23 43 CONECT 23 22 17 44 CONECT 24 3 25 45 CONECT 25 24 26 27 28 CONECT 26 25 46 47 48 CONECT 27 25 CONECT 28 25 CONECT 29 1 CONECT 30 1 CONECT 31 2 CONECT 32 2 CONECT 33 3 CONECT 34 4 CONECT 35 4 CONECT 36 5 CONECT 37 5 CONECT 38 6 CONECT 39 12 CONECT 40 13 CONECT 41 20 CONECT 42 21 CONECT 43 22 CONECT 44 23 CONECT 45 24 CONECT 46 26 CONECT 47 26 CONECT 48 26 MASTER 0 0 0 0 0 0 0 0 48 0 48 0 END M END $$$$