D0R3JM AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 S UNL 1 1.720 3.210 -0.143 1.00 0.00 S HETATM 2 C UNL 1 2.645 1.969 0.568 1.00 0.00 C HETATM 3 N UNL 1 2.720 2.023 1.875 1.00 0.00 N HETATM 4 N UNL 1 2.207 3.204 2.355 1.00 0.00 N HETATM 5 C UNL 1 1.707 3.973 1.399 1.00 0.00 C HETATM 6 C UNL 1 1.171 7.271 3.128 1.00 0.00 C HETATM 7 C UNL 1 0.505 8.018 2.163 1.00 0.00 C HETATM 8 C UNL 1 0.193 7.443 0.934 1.00 0.00 C HETATM 9 C UNL 1 0.556 6.118 0.660 1.00 0.00 C HETATM 10 C UNL 1 1.239 5.351 1.618 1.00 0.00 C HETATM 11 C UNL 1 1.529 5.951 2.856 1.00 0.00 C HETATM 12 N UNL 1 3.167 0.839 -0.084 1.00 0.00 N HETATM 13 S UNL 1 4.422 1.172 -1.148 1.00 0.00 S HETATM 14 C UNL 1 5.900 1.503 -0.086 1.00 0.00 C HETATM 15 C UNL 1 4.553 7.060 -0.792 1.00 0.00 C HETATM 16 C UNL 1 4.890 5.670 -0.615 1.00 0.00 C HETATM 17 C UNL 1 5.657 4.329 0.436 1.00 0.00 C HETATM 18 C UNL 1 6.243 2.695 1.137 1.00 0.00 C HETATM 19 C UNL 1 6.427 1.053 0.916 1.00 0.00 C HETATM 20 O UNL 1 6.062 5.141 1.736 1.00 0.00 O HETATM 21 C UNL 1 6.578 6.443 1.474 1.00 0.00 C HETATM 22 O UNL 1 4.214 4.805 -1.551 1.00 0.00 O HETATM 23 C UNL 1 3.677 5.376 -2.734 1.00 0.00 C HETATM 24 O UNL 1 4.751 -0.107 -1.755 1.00 0.00 O HETATM 25 O UNL 1 4.146 2.304 -1.984 1.00 0.00 O HETATM 26 H UNL 1 1.422 7.710 4.089 1.00 0.00 H HETATM 27 H UNL 1 0.229 9.049 2.371 1.00 0.00 H HETATM 28 H UNL 1 -0.334 8.027 0.182 1.00 0.00 H HETATM 29 H UNL 1 0.297 5.709 -0.314 1.00 0.00 H HETATM 30 H UNL 1 2.059 5.386 3.623 1.00 0.00 H HETATM 31 H UNL 1 3.439 0.127 0.590 1.00 0.00 H HETATM 32 H UNL 1 4.311 8.055 -0.919 1.00 0.00 H HETATM 33 H UNL 1 6.504 2.923 2.204 1.00 0.00 H HETATM 34 H UNL 1 6.322 0.320 1.681 1.00 0.00 H HETATM 35 H UNL 1 7.182 6.746 2.336 1.00 0.00 H HETATM 36 H UNL 1 5.768 7.175 1.416 1.00 0.00 H HETATM 37 H UNL 1 7.225 6.469 0.592 1.00 0.00 H HETATM 38 H UNL 1 3.387 4.552 -3.395 1.00 0.00 H HETATM 39 H UNL 1 4.419 5.980 -3.266 1.00 0.00 H HETATM 40 H UNL 1 2.774 5.949 -2.507 1.00 0.00 H CONECT 1 5 2 CONECT 2 1 3 12 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 1 4 10 CONECT 6 11 7 26 CONECT 7 6 8 27 CONECT 8 7 9 28 CONECT 9 8 10 29 CONECT 10 5 9 11 CONECT 11 6 10 30 CONECT 12 2 13 31 CONECT 13 12 14 24 25 CONECT 14 13 15 19 CONECT 15 14 16 32 CONECT 16 15 17 22 CONECT 17 16 18 20 CONECT 18 17 19 33 CONECT 19 18 14 34 CONECT 20 17 21 CONECT 21 20 35 36 37 CONECT 22 16 23 CONECT 23 22 38 39 40 CONECT 24 13 CONECT 25 13 CONECT 26 6 CONECT 27 7 CONECT 28 8 CONECT 29 9 CONECT 30 11 CONECT 31 12 CONECT 32 15 CONECT 33 18 CONECT 34 19 CONECT 35 21 CONECT 36 21 CONECT 37 21 CONECT 38 23 CONECT 39 23 CONECT 40 23 MASTER 0 0 0 0 0 0 0 0 40 0 40 0 END M END $$$$