D0B3XW AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.620 8.119 4.645 1.00 0.00 C HETATM 2 C UNL 1 3.749 9.398 5.128 1.00 0.00 C HETATM 3 C UNL 1 2.604 9.985 5.635 1.00 0.00 C HETATM 4 C UNL 1 1.391 9.319 5.437 1.00 0.00 C HETATM 5 C UNL 1 1.398 7.937 5.345 1.00 0.00 C HETATM 6 N UNL 1 2.542 7.346 4.890 1.00 0.00 N HETATM 7 C UNL 1 0.185 7.062 5.670 1.00 0.00 C HETATM 8 C UNL 1 -0.207 6.154 4.717 1.00 0.00 C HETATM 9 C UNL 1 0.806 5.254 4.470 1.00 0.00 C HETATM 10 C UNL 1 1.318 4.633 5.621 1.00 0.00 C HETATM 11 C UNL 1 0.810 5.113 6.857 1.00 0.00 C HETATM 12 C UNL 1 0.177 6.364 6.864 1.00 0.00 C HETATM 13 CL UNL 1 -1.054 6.709 8.032 1.00 0.00 Cl HETATM 14 N UNL 1 1.351 5.255 3.151 1.00 0.00 N HETATM 15 C UNL 1 0.906 6.243 2.241 1.00 0.00 C HETATM 16 C UNL 1 1.154 6.182 0.771 1.00 0.00 C HETATM 17 O UNL 1 0.160 7.182 2.552 1.00 0.00 O HETATM 18 C UNL 1 0.487 7.238 0.092 1.00 0.00 C HETATM 19 C UNL 1 -0.365 6.939 -0.968 1.00 0.00 C HETATM 20 C UNL 1 -0.446 5.639 -1.439 1.00 0.00 C HETATM 21 C UNL 1 0.488 4.689 -0.995 1.00 0.00 C HETATM 22 C UNL 1 1.296 4.971 0.118 1.00 0.00 C HETATM 23 CL UNL 1 2.481 3.817 0.611 1.00 0.00 Cl HETATM 24 N UNL 1 -1.630 5.249 -2.212 1.00 0.00 N HETATM 25 S UNL 1 -2.827 4.463 -1.253 1.00 0.00 S HETATM 26 O UNL 1 -2.233 3.258 -0.727 1.00 0.00 O HETATM 27 O UNL 1 -3.350 5.457 -0.329 1.00 0.00 O HETATM 28 C UNL 1 2.612 11.329 5.997 1.00 0.00 C HETATM 29 C UNL 1 1.666 12.093 5.335 1.00 0.00 C HETATM 30 C UNL 1 0.416 11.498 5.138 1.00 0.00 C HETATM 31 C UNL 1 0.293 10.108 5.096 1.00 0.00 C HETATM 32 C UNL 1 -1.365 4.559 -3.490 1.00 0.00 C HETATM 33 C UNL 1 -2.647 4.532 -4.318 1.00 0.00 C HETATM 34 C UNL 1 -3.611 3.525 -3.716 1.00 0.00 C HETATM 35 C UNL 1 -4.126 4.011 -2.374 1.00 0.00 C HETATM 36 H UNL 1 4.385 7.680 4.011 1.00 0.00 H HETATM 37 H UNL 1 4.655 9.971 4.977 1.00 0.00 H HETATM 38 H UNL 1 -1.184 5.671 4.856 1.00 0.00 H HETATM 39 H UNL 1 2.099 3.892 5.621 1.00 0.00 H HETATM 40 H UNL 1 0.877 4.530 7.778 1.00 0.00 H HETATM 41 H UNL 1 2.214 4.763 2.980 1.00 0.00 H HETATM 42 H UNL 1 0.422 8.218 0.551 1.00 0.00 H HETATM 43 H UNL 1 -1.061 7.705 -1.299 1.00 0.00 H HETATM 44 H UNL 1 0.507 3.693 -1.426 1.00 0.00 H HETATM 45 H UNL 1 2.446 11.439 7.094 1.00 0.00 H HETATM 46 H UNL 1 2.084 12.511 4.394 1.00 0.00 H HETATM 47 H UNL 1 -0.485 12.092 5.223 1.00 0.00 H HETATM 48 H UNL 1 -0.540 9.656 4.559 1.00 0.00 H HETATM 49 H UNL 1 -0.996 3.545 -3.303 1.00 0.00 H HETATM 50 H UNL 1 -0.598 5.103 -4.047 1.00 0.00 H HETATM 51 H UNL 1 -2.419 4.251 -5.350 1.00 0.00 H HETATM 52 H UNL 1 -3.123 5.519 -4.343 1.00 0.00 H HETATM 53 H UNL 1 -3.121 2.547 -3.612 1.00 0.00 H HETATM 54 H UNL 1 -4.459 3.362 -4.400 1.00 0.00 H HETATM 55 H UNL 1 -4.714 3.220 -1.882 1.00 0.00 H HETATM 56 H UNL 1 -4.792 4.867 -2.508 1.00 0.00 H CONECT 1 2 6 36 CONECT 2 1 3 37 CONECT 3 2 4 28 CONECT 4 3 5 31 CONECT 5 4 6 7 CONECT 6 5 1 CONECT 7 5 8 12 CONECT 8 7 9 38 CONECT 9 8 10 14 CONECT 10 9 11 39 CONECT 11 10 12 40 CONECT 12 11 7 13 CONECT 13 12 CONECT 14 9 15 41 CONECT 15 14 16 17 CONECT 16 15 18 22 CONECT 17 15 CONECT 18 16 19 42 CONECT 19 18 20 43 CONECT 20 19 21 24 CONECT 21 20 22 44 CONECT 22 21 16 23 CONECT 23 22 CONECT 24 20 25 32 CONECT 25 24 26 27 35 CONECT 26 25 CONECT 27 25 CONECT 28 3 29 45 CONECT 29 28 30 46 CONECT 30 29 31 47 CONECT 31 30 4 48 CONECT 32 24 33 49 50 CONECT 33 32 34 51 52 CONECT 34 33 35 53 54 CONECT 35 34 25 55 56 CONECT 36 1 CONECT 37 2 CONECT 38 8 CONECT 39 10 CONECT 40 11 CONECT 41 14 CONECT 42 18 CONECT 43 19 CONECT 44 21 CONECT 45 28 CONECT 46 29 CONECT 47 30 CONECT 48 31 CONECT 49 32 CONECT 50 32 CONECT 51 33 CONECT 52 33 CONECT 53 34 CONECT 54 34 CONECT 55 35 CONECT 56 35 MASTER 0 0 0 0 0 0 0 0 56 0 56 0 END M END $$$$