D01ITP AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 7.102 0.833 -1.733 1.00 0.00 C HETATM 2 C UNL 1 8.516 1.054 -1.690 1.00 0.00 C HETATM 3 N UNL 1 8.993 1.927 -0.856 1.00 0.00 N HETATM 4 C UNL 1 8.208 2.212 0.261 1.00 0.00 C HETATM 5 C UNL 1 6.841 1.858 0.427 1.00 0.00 C HETATM 6 N UNL 1 6.330 1.075 -0.616 1.00 0.00 N HETATM 7 C UNL 1 8.959 2.501 1.399 1.00 0.00 C HETATM 8 C UNL 1 8.349 2.522 2.656 1.00 0.00 C HETATM 9 C UNL 1 6.958 2.421 2.744 1.00 0.00 C HETATM 10 C UNL 1 6.183 2.089 1.637 1.00 0.00 C HETATM 11 C UNL 1 9.542 0.049 -2.118 1.00 0.00 C HETATM 12 C UNL 1 5.420 0.015 -0.683 1.00 0.00 C HETATM 13 N UNL 1 5.130 0.017 -1.994 1.00 0.00 N HETATM 14 N UNL 1 6.346 0.251 -2.643 1.00 0.00 N HETATM 15 C UNL 1 5.605 -1.308 0.031 1.00 0.00 C HETATM 16 C UNL 1 6.940 -1.736 0.080 1.00 0.00 C HETATM 17 C UNL 1 7.346 -2.750 -0.791 1.00 0.00 C HETATM 18 C UNL 1 6.392 -3.482 -1.493 1.00 0.00 C HETATM 19 C UNL 1 5.044 -3.326 -1.170 1.00 0.00 C HETATM 20 C UNL 1 4.656 -2.276 -0.337 1.00 0.00 C HETATM 21 CL UNL 1 2.993 -2.084 0.076 1.00 0.00 Cl HETATM 22 O UNL 1 4.863 1.899 1.904 1.00 0.00 O HETATM 23 C UNL 1 3.922 2.512 1.021 1.00 0.00 C HETATM 24 H UNL 1 10.043 2.544 1.305 1.00 0.00 H HETATM 25 H UNL 1 8.980 2.554 3.535 1.00 0.00 H HETATM 26 H UNL 1 6.495 2.518 3.727 1.00 0.00 H HETATM 27 H UNL 1 9.226 -0.613 -2.905 1.00 0.00 H HETATM 28 H UNL 1 9.738 -0.558 -1.208 1.00 0.00 H HETATM 29 H UNL 1 10.493 0.544 -2.338 1.00 0.00 H HETATM 30 H UNL 1 7.705 -1.121 0.549 1.00 0.00 H HETATM 31 H UNL 1 8.404 -2.909 -0.987 1.00 0.00 H HETATM 32 H UNL 1 6.694 -4.172 -2.276 1.00 0.00 H HETATM 33 H UNL 1 4.300 -3.964 -1.634 1.00 0.00 H HETATM 34 H UNL 1 2.993 2.665 1.581 1.00 0.00 H HETATM 35 H UNL 1 3.684 1.838 0.196 1.00 0.00 H HETATM 36 H UNL 1 4.247 3.488 0.644 1.00 0.00 H CONECT 1 2 6 14 CONECT 2 1 3 11 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 6 10 CONECT 6 5 1 12 CONECT 7 4 8 24 CONECT 8 7 9 25 CONECT 9 8 10 26 CONECT 10 9 5 22 CONECT 11 2 27 28 29 CONECT 12 6 13 15 CONECT 13 12 14 CONECT 14 13 1 CONECT 15 12 16 20 CONECT 16 15 17 30 CONECT 17 16 18 31 CONECT 18 17 19 32 CONECT 19 18 20 33 CONECT 20 19 15 21 CONECT 21 20 CONECT 22 10 23 CONECT 23 22 34 35 36 CONECT 24 7 CONECT 25 8 CONECT 26 9 CONECT 27 11 CONECT 28 11 CONECT 29 11 CONECT 30 16 CONECT 31 17 CONECT 32 18 CONECT 33 19 CONECT 34 23 CONECT 35 23 CONECT 36 23 MASTER 0 0 0 0 0 0 0 0 36 0 36 0 END M END $$$$