@MOLECULE FDBD00744 28 28 0 0 0 SMALL GASTEIGER @ATOM 1 P 0.8024 1.6071 0.2558 P.3 1 UNK 0.3713 2 P1 2.6095 -0.9913 -0.1967 P.3 1 UNK 0.3713 3 O 0.7950 -0.6166 1.5433 O.3 1 UNK -0.3669 4 O1 1.1555 2.0721 -1.2514 O.3 1 UNK -0.3217 5 O2 2.0959 2.0871 1.0975 O.3 1 UNK -0.3217 6 O3 2.8716 -0.5480 -1.7288 O.3 1 UNK -0.3217 7 O4 3.6744 -0.1060 0.6360 O.3 1 UNK -0.3217 8 O5 -0.5061 2.1086 0.7908 O.2 1 UNK -0.2551 9 O6 2.6724 -2.4676 0.0619 O.2 1 UNK -0.2551 10 N -3.4719 0.7474 -0.7368 N.ar 1 UNK -0.2630 11 C 0.9781 -0.2086 0.1869 C.3 1 UNK 0.2711 12 C1 -0.0827 -0.8998 -0.7075 C.3 1 UNK 0.0258 13 C2 -1.5297 -0.6183 -0.3882 C.ar 1 UNK -0.0253 14 C3 -2.2145 -1.4200 0.5018 C.ar 1 UNK -0.0556 15 C4 -2.1781 0.4400 -0.9799 C.ar 1 UNK 0.0308 16 C5 -3.5473 -1.1355 0.7776 C.ar 1 UNK -0.0433 17 C6 -4.1246 -0.0504 0.1379 C.ar 1 UNK 0.0276 18 H 1.4586 -0.1843 2.1034 H 1 UNK 0.2117 19 H1 1.0885 3.0376 -1.3160 H 1 UNK 0.2198 20 H2 2.0847 3.0531 1.1847 H 1 UNK 0.2198 21 H3 3.7176 -0.9139 -2.0311 H 1 UNK 0.2198 22 H4 4.5682 -0.4530 0.4893 H 1 UNK 0.2198 23 H5 0.0665 -1.9564 -0.6287 H 1 UNK 0.0354 24 H6 0.0713 -0.4967 -1.6866 H 1 UNK 0.0354 25 H7 -1.7446 -2.2187 0.9559 H 1 UNK 0.0621 26 H8 -1.6506 1.0292 -1.6429 H 1 UNK 0.0832 27 H9 -4.0895 -1.7143 1.4380 H 1 UNK 0.0633 28 H10 -5.1138 0.1618 0.3417 H 1 UNK 0.0829 @BOND 1 1 4 1 2 1 5 1 3 1 8 2 4 1 11 1 5 2 6 1 6 2 7 1 7 2 9 2 8 2 11 1 9 3 11 1 10 10 15 ar 11 10 17 ar 12 11 12 1 13 12 13 1 14 13 14 ar 15 13 15 ar 16 14 16 ar 17 16 17 ar 18 3 18 1 19 4 19 1 20 5 20 1 21 6 21 1 22 7 22 1 23 12 23 1 24 12 24 1 25 14 25 1 26 15 26 1 27 16 27 1 28 17 28 1