@MOLECULE FDBD00587 33 33 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.6234 0.8272 -1.8756 O.3 1 UNK -0.3815 2 O1 0.8263 -2.4357 -0.1433 O.3 1 UNK -0.4947 3 O2 -3.0675 1.4559 0.1541 O.3 1 UNK -0.4951 4 N 3.5491 1.6775 0.0522 N.4 1 UNK 0.2226 5 C 1.6141 0.2791 -0.5546 C.3 1 UNK 0.1256 6 C1 2.1847 1.3070 0.4484 C.3 1 UNK 0.0036 7 C2 0.1863 -0.1291 -0.2611 C.ar 1 UNK 0.0313 8 C3 2.2389 0.7650 1.8781 C.3 1 UNK -0.0190 9 C4 -0.1265 -1.4644 -0.0719 C.ar 1 UNK 0.1261 10 C5 -0.7824 0.8579 -0.1894 C.ar 1 UNK -0.0106 11 C6 -2.1032 0.4984 0.0796 C.ar 1 UNK 0.1207 12 C7 -1.4472 -1.8237 0.1972 C.ar 1 UNK -0.0161 13 C8 -2.4355 -0.8423 0.2727 C.ar 1 UNK -0.0165 14 C9 0.3984 -3.7797 0.0671 C.3 1 UNK 0.0788 15 C10 -2.6586 2.8071 -0.0537 C.3 1 UNK 0.0788 16 H 2.5246 1.1031 -2.1049 H 1 UNK 0.2105 17 H1 3.5393 2.0427 -0.9001 H 1 UNK 0.1998 18 H2 4.1507 0.8549 0.0947 H 1 UNK 0.1998 19 H3 3.9052 2.3923 0.6868 H 1 UNK 0.1998 20 H4 2.2421 -0.5826 -0.4653 H 1 UNK 0.0702 21 H5 1.5287 2.1521 0.4312 H 1 UNK 0.0876 22 H6 2.8917 -0.0821 1.9139 H 1 UNK 0.0285 23 H7 1.2569 0.4718 2.1859 H 1 UNK 0.0285 24 H8 2.6060 1.5262 2.5344 H 1 UNK 0.0285 25 H9 -0.5301 1.8482 -0.3333 H 1 UNK 0.0659 26 H10 -1.6931 -2.8157 0.3404 H 1 UNK 0.0655 27 H11 -3.4126 -1.1082 0.4715 H 1 UNK 0.0655 28 H12 1.2377 -4.4383 -0.0155 H 1 UNK 0.0660 29 H13 -0.3333 -4.0404 -0.6688 H 1 UNK 0.0660 30 H14 -0.0302 -3.8689 1.0435 H 1 UNK 0.0660 31 H15 -3.5070 3.4536 0.0315 H 1 UNK 0.0660 32 H16 -2.2325 2.9046 -1.0303 H 1 UNK 0.0660 33 H17 -1.9297 3.0763 0.6819 H 1 UNK 0.0660 @BOND 1 1 5 1 2 2 9 1 3 2 14 1 4 3 11 1 5 3 15 1 6 4 6 1 7 5 6 1 8 5 7 1 9 6 8 1 10 7 9 ar 11 7 10 ar 12 9 12 ar 13 10 11 ar 14 11 13 ar 15 12 13 ar 16 1 16 1 17 4 17 1 18 4 18 1 19 4 19 1 20 5 20 1 21 6 21 1 22 8 22 1 23 8 23 1 24 8 24 1 25 10 25 1 26 12 26 1 27 13 27 1 28 14 28 1 29 14 29 1 30 14 30 1 31 15 31 1 32 15 32 1 33 15 33 1