D00JGN AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 4.261 0.087 -3.002 1.00 0.00 N HETATM 2 C UNL 1 4.091 -1.204 -3.286 1.00 0.00 C HETATM 3 N UNL 1 2.983 -1.846 -2.678 1.00 0.00 N HETATM 4 C UNL 1 2.452 -1.346 -1.458 1.00 0.00 C HETATM 5 C UNL 1 3.211 -0.402 -0.873 1.00 0.00 C HETATM 6 C UNL 1 3.630 0.497 -1.847 1.00 0.00 C HETATM 7 N UNL 1 0.960 -1.113 -1.219 1.00 0.00 N HETATM 8 C UNL 1 -0.021 -2.061 -0.562 1.00 0.00 C HETATM 9 N UNL 1 5.023 -1.910 -4.129 1.00 0.00 N HETATM 10 C UNL 1 6.142 -1.440 -5.116 1.00 0.00 C HETATM 11 C UNL 1 7.143 -2.569 -5.807 1.00 0.00 C HETATM 12 C UNL 1 8.614 -2.060 -6.447 1.00 0.00 C HETATM 13 C UNL 1 9.490 -1.004 -5.643 1.00 0.00 C HETATM 14 C UNL 1 8.592 0.101 -5.068 1.00 0.00 C HETATM 15 C UNL 1 7.196 -0.428 -4.588 1.00 0.00 C HETATM 16 O UNL 1 10.557 -0.372 -6.440 1.00 0.00 O HETATM 17 C UNL 1 -1.160 -1.594 0.452 1.00 0.00 C HETATM 18 C UNL 1 -2.419 -1.255 -0.338 1.00 0.00 C HETATM 19 C UNL 1 -1.985 -1.565 -1.746 1.00 0.00 C HETATM 20 O UNL 1 -0.873 -2.480 -1.651 1.00 0.00 O HETATM 21 C UNL 1 11.368 0.545 -5.657 1.00 0.00 C HETATM 22 C UNL 1 12.418 1.332 -6.435 1.00 0.00 C HETATM 23 C UNL 1 4.409 -0.870 -0.131 1.00 0.00 C HETATM 24 N UNL 1 5.381 -1.184 0.377 1.00 0.00 N HETATM 25 H UNL 1 3.372 1.539 -1.770 1.00 0.00 H HETATM 26 H UNL 1 0.658 -1.250 -2.200 1.00 0.00 H HETATM 27 H UNL 1 0.492 -2.914 -0.116 1.00 0.00 H HETATM 28 H UNL 1 4.441 -2.629 -4.563 1.00 0.00 H HETATM 29 H UNL 1 5.560 -0.964 -5.931 1.00 0.00 H HETATM 30 H UNL 1 6.607 -3.074 -6.626 1.00 0.00 H HETATM 31 H UNL 1 7.384 -3.342 -5.068 1.00 0.00 H HETATM 32 H UNL 1 8.451 -1.676 -7.468 1.00 0.00 H HETATM 33 H UNL 1 9.246 -2.954 -6.617 1.00 0.00 H HETATM 34 H UNL 1 10.004 -1.548 -4.836 1.00 0.00 H HETATM 35 H UNL 1 8.460 0.875 -5.859 1.00 0.00 H HETATM 36 H UNL 1 9.070 0.661 -4.259 1.00 0.00 H HETATM 37 H UNL 1 7.655 -1.138 -3.876 1.00 0.00 H HETATM 38 H UNL 1 7.169 -0.313 -5.675 1.00 0.00 H HETATM 39 H UNL 1 -0.924 -0.831 1.211 1.00 0.00 H HETATM 40 H UNL 1 -1.473 -2.472 1.029 1.00 0.00 H HETATM 41 H UNL 1 -2.774 -0.221 -0.224 1.00 0.00 H HETATM 42 H UNL 1 -3.280 -1.887 -0.060 1.00 0.00 H HETATM 43 H UNL 1 -2.782 -2.000 -2.345 1.00 0.00 H HETATM 44 H UNL 1 -1.648 -0.634 -2.222 1.00 0.00 H HETATM 45 H UNL 1 11.863 -0.016 -4.855 1.00 0.00 H HETATM 46 H UNL 1 10.734 1.313 -5.212 1.00 0.00 H HETATM 47 H UNL 1 13.226 0.692 -6.804 1.00 0.00 H HETATM 48 H UNL 1 12.868 2.096 -5.790 1.00 0.00 H HETATM 49 H UNL 1 11.973 1.847 -7.297 1.00 0.00 H CONECT 1 2 6 CONECT 2 1 3 9 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 6 23 CONECT 6 5 1 25 CONECT 7 4 8 26 CONECT 8 7 17 20 27 CONECT 9 2 10 28 CONECT 10 9 11 15 29 CONECT 11 10 12 30 31 CONECT 12 11 13 32 33 CONECT 13 12 14 16 34 CONECT 14 13 15 35 36 CONECT 15 14 10 37 38 CONECT 16 13 21 CONECT 17 8 18 39 40 CONECT 18 17 19 41 42 CONECT 19 18 20 43 44 CONECT 20 19 8 CONECT 21 16 22 45 46 CONECT 22 21 47 48 49 CONECT 23 5 24 CONECT 24 23 CONECT 25 6 CONECT 26 7 CONECT 27 8 CONECT 28 9 CONECT 29 10 CONECT 30 11 CONECT 31 11 CONECT 32 12 CONECT 33 12 CONECT 34 13 CONECT 35 14 CONECT 36 14 CONECT 37 15 CONECT 38 15 CONECT 39 17 CONECT 40 17 CONECT 41 18 CONECT 42 18 CONECT 43 19 CONECT 44 19 CONECT 45 21 CONECT 46 21 CONECT 47 22 CONECT 48 22 CONECT 49 22 MASTER 0 0 0 0 0 0 0 0 49 0 49 0 END M END $$$$