D0W2YK AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 9.000 -2.199 1.953 1.00 0.00 N HETATM 2 C UNL 1 8.198 -1.232 2.558 1.00 0.00 C HETATM 3 C UNL 1 7.630 -1.498 3.960 1.00 0.00 C HETATM 4 O UNL 1 8.154 -0.071 2.144 1.00 0.00 O HETATM 5 C UNL 1 7.842 -0.351 4.737 1.00 0.00 C HETATM 6 C UNL 1 9.151 -0.155 5.117 1.00 0.00 C HETATM 7 C UNL 1 9.919 -1.300 5.254 1.00 0.00 C HETATM 8 N UNL 1 9.392 -2.571 5.122 1.00 0.00 N HETATM 9 C UNL 1 8.182 -2.628 4.534 1.00 0.00 C HETATM 10 O UNL 1 7.507 -3.793 4.270 1.00 0.00 O HETATM 11 S UNL 1 9.850 1.451 5.222 1.00 0.00 S HETATM 12 C UNL 1 7.810 -5.003 4.969 1.00 0.00 C HETATM 13 C UNL 1 7.149 -4.948 6.341 1.00 0.00 C HETATM 14 C UNL 1 8.786 2.621 4.429 1.00 0.00 C HETATM 15 O UNL 1 9.871 1.768 6.646 1.00 0.00 O HETATM 16 O UNL 1 11.083 1.407 4.463 1.00 0.00 O HETATM 17 C UNL 1 8.504 -3.486 1.472 1.00 0.00 C HETATM 18 C UNL 1 9.580 -4.594 1.558 1.00 0.00 C HETATM 19 N UNL 1 10.900 -4.161 1.008 1.00 0.00 N HETATM 20 C UNL 1 11.320 -2.795 1.365 1.00 0.00 C HETATM 21 C UNL 1 10.184 -1.766 1.227 1.00 0.00 C HETATM 22 C UNL 1 11.920 -5.150 0.936 1.00 0.00 C HETATM 23 C UNL 1 13.309 -4.881 1.028 1.00 0.00 C HETATM 24 C UNL 1 14.281 -5.798 0.598 1.00 0.00 C HETATM 25 C UNL 1 13.885 -7.068 0.232 1.00 0.00 C HETATM 26 C UNL 1 12.599 -7.462 0.575 1.00 0.00 C HETATM 27 C UNL 1 11.601 -6.483 0.670 1.00 0.00 C HETATM 28 F UNL 1 13.768 -3.694 1.451 1.00 0.00 F HETATM 29 C UNL 1 7.224 -6.189 4.163 1.00 0.00 C HETATM 30 F UNL 1 6.897 -5.834 2.895 1.00 0.00 F HETATM 31 F UNL 1 8.123 -7.197 4.055 1.00 0.00 F HETATM 32 F UNL 1 6.105 -6.706 4.722 1.00 0.00 F HETATM 33 C UNL 1 14.562 -7.782 -0.823 1.00 0.00 C HETATM 34 N UNL 1 15.016 -8.300 -1.744 1.00 0.00 N HETATM 35 H UNL 1 7.121 -0.236 5.597 1.00 0.00 H HETATM 36 H UNL 1 10.989 -1.230 5.430 1.00 0.00 H HETATM 37 H UNL 1 8.893 -5.147 5.053 1.00 0.00 H HETATM 38 H UNL 1 6.104 -4.629 6.245 1.00 0.00 H HETATM 39 H UNL 1 7.643 -4.211 6.981 1.00 0.00 H HETATM 40 H UNL 1 7.172 -5.920 6.843 1.00 0.00 H HETATM 41 H UNL 1 7.845 2.700 4.977 1.00 0.00 H HETATM 42 H UNL 1 8.604 2.344 3.393 1.00 0.00 H HETATM 43 H UNL 1 9.293 3.594 4.442 1.00 0.00 H HETATM 44 H UNL 1 8.220 -3.340 0.421 1.00 0.00 H HETATM 45 H UNL 1 7.582 -3.771 1.975 1.00 0.00 H HETATM 46 H UNL 1 9.175 -5.450 1.007 1.00 0.00 H HETATM 47 H UNL 1 9.719 -4.901 2.602 1.00 0.00 H HETATM 48 H UNL 1 12.122 -2.457 0.699 1.00 0.00 H HETATM 49 H UNL 1 11.682 -2.792 2.401 1.00 0.00 H HETATM 50 H UNL 1 10.526 -0.799 1.610 1.00 0.00 H HETATM 51 H UNL 1 9.904 -1.633 0.175 1.00 0.00 H HETATM 52 H UNL 1 15.306 -5.467 0.475 1.00 0.00 H HETATM 53 H UNL 1 12.568 -8.152 1.443 1.00 0.00 H HETATM 54 H UNL 1 10.584 -6.819 0.494 1.00 0.00 H CONECT 1 2 17 21 CONECT 2 1 3 4 CONECT 3 2 5 9 CONECT 4 2 CONECT 5 3 6 35 CONECT 6 5 7 11 CONECT 7 6 8 36 CONECT 8 7 9 CONECT 9 8 3 10 CONECT 10 9 12 CONECT 11 6 14 15 16 CONECT 12 13 10 29 37 CONECT 13 12 38 39 40 CONECT 14 11 41 42 43 CONECT 15 11 CONECT 16 11 CONECT 17 1 18 44 45 CONECT 18 17 19 46 47 CONECT 19 18 20 22 CONECT 20 19 21 48 49 CONECT 21 20 1 50 51 CONECT 22 19 23 27 CONECT 23 22 24 28 CONECT 24 23 25 52 CONECT 25 33 24 26 CONECT 26 25 27 53 CONECT 27 26 22 54 CONECT 28 23 CONECT 29 30 31 32 12 CONECT 30 29 CONECT 31 29 CONECT 32 29 CONECT 33 34 25 CONECT 34 33 CONECT 35 5 CONECT 36 7 CONECT 37 12 CONECT 38 13 CONECT 39 13 CONECT 40 13 CONECT 41 14 CONECT 42 14 CONECT 43 14 CONECT 44 17 CONECT 45 17 CONECT 46 18 CONECT 47 18 CONECT 48 20 CONECT 49 20 CONECT 50 21 CONECT 51 21 CONECT 52 24 CONECT 53 26 CONECT 54 27 MASTER 0 0 0 0 0 0 0 0 54 0 54 0 END M END $$$$