D0UU0V AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.119 -0.273 -0.946 1.00 0.00 C HETATM 2 C UNL 1 3.993 -0.315 -1.062 1.00 0.00 C HETATM 3 C UNL 1 5.124 0.049 -0.069 1.00 0.00 C HETATM 4 C UNL 1 4.947 0.522 1.220 1.00 0.00 C HETATM 5 C UNL 1 3.427 0.588 1.398 1.00 0.00 C HETATM 6 C UNL 1 2.270 0.238 0.451 1.00 0.00 C HETATM 7 N UNL 1 6.147 0.854 2.128 1.00 0.00 N HETATM 8 C UNL 1 7.806 1.046 2.657 1.00 0.00 C HETATM 9 C UNL 1 9.722 1.015 2.570 1.00 0.00 C HETATM 10 C UNL 1 10.536 1.560 4.065 1.00 0.00 C HETATM 11 C UNL 1 9.695 1.901 5.001 1.00 0.00 C HETATM 12 C UNL 1 8.299 1.752 4.594 1.00 0.00 C HETATM 13 N UNL 1 7.215 1.463 3.800 1.00 0.00 N HETATM 14 C UNL 1 12.093 1.627 4.249 1.00 0.00 C HETATM 15 C UNL 1 12.288 2.245 5.945 1.00 0.00 C HETATM 16 C UNL 1 13.347 2.511 6.677 1.00 0.00 C HETATM 17 C UNL 1 13.747 2.084 5.503 1.00 0.00 C HETATM 18 C UNL 1 14.200 1.621 4.234 1.00 0.00 C HETATM 19 C UNL 1 13.352 1.290 3.326 1.00 0.00 C HETATM 20 O UNL 1 14.165 0.876 2.191 1.00 0.00 O HETATM 21 C UNL 1 13.428 0.371 0.805 1.00 0.00 C HETATM 22 C UNL 1 4.988 -0.793 -2.370 1.00 0.00 C HETATM 23 S UNL 1 4.163 -2.023 -3.319 1.00 0.00 S HETATM 24 O UNL 1 2.944 -1.407 -3.789 1.00 0.00 O HETATM 25 O UNL 1 5.157 -2.559 -4.219 1.00 0.00 O HETATM 26 N UNL 1 3.715 -3.278 -2.262 1.00 0.00 N HETATM 27 H UNL 1 0.902 -0.022 -0.255 1.00 0.00 H HETATM 28 H UNL 1 6.188 -0.001 -0.208 1.00 0.00 H HETATM 29 H UNL 1 2.731 0.879 2.202 1.00 0.00 H HETATM 30 H UNL 1 2.509 -0.185 -0.704 1.00 0.00 H HETATM 31 H UNL 1 5.489 1.168 2.980 1.00 0.00 H HETATM 32 H UNL 1 10.740 1.030 2.611 1.00 0.00 H HETATM 33 H UNL 1 9.201 2.236 5.922 1.00 0.00 H HETATM 34 H UNL 1 8.854 1.469 3.817 1.00 0.00 H HETATM 35 H UNL 1 11.712 2.598 6.913 1.00 0.00 H HETATM 36 H UNL 1 14.328 2.656 7.074 1.00 0.00 H HETATM 37 H UNL 1 14.764 2.144 5.669 1.00 0.00 H HETATM 38 H UNL 1 15.244 1.618 4.226 1.00 0.00 H HETATM 39 H UNL 1 14.061 0.055 -0.062 1.00 0.00 H HETATM 40 H UNL 1 12.792 1.182 0.402 1.00 0.00 H HETATM 41 H UNL 1 12.791 -0.508 1.018 1.00 0.00 H HETATM 42 H UNL 1 5.993 -1.165 -2.045 1.00 0.00 H HETATM 43 H UNL 1 5.293 0.062 -3.026 1.00 0.00 H HETATM 44 H UNL 1 2.957 -3.107 -1.600 1.00 0.00 H HETATM 45 H UNL 1 4.448 -3.883 -1.890 1.00 0.00 H CONECT 1 2 6 27 CONECT 2 1 3 22 CONECT 3 2 4 28 CONECT 4 3 5 7 CONECT 5 4 6 29 CONECT 6 5 1 30 CONECT 7 4 8 31 CONECT 8 7 9 13 CONECT 9 8 10 32 CONECT 10 9 11 14 CONECT 11 10 12 33 CONECT 12 11 13 34 CONECT 13 12 8 CONECT 14 10 15 19 CONECT 15 14 16 35 CONECT 16 15 17 36 CONECT 17 16 18 37 CONECT 18 17 19 38 CONECT 19 18 14 20 CONECT 20 19 21 CONECT 21 20 39 40 41 CONECT 22 2 23 42 43 CONECT 23 22 24 25 26 CONECT 24 23 CONECT 25 23 CONECT 26 23 44 45 CONECT 27 1 CONECT 28 3 CONECT 29 5 CONECT 30 6 CONECT 31 7 CONECT 32 9 CONECT 33 11 CONECT 34 12 CONECT 35 15 CONECT 36 16 CONECT 37 17 CONECT 38 18 CONECT 39 21 CONECT 40 21 CONECT 41 21 CONECT 42 22 CONECT 43 22 CONECT 44 26 CONECT 45 26 MASTER 0 0 0 0 0 0 0 0 45 0 45 0 END M END $$$$