@MOLECULE FDBD01079 25 25 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.5189 -2.0482 0.5529 O.3 1 UNK -0.5033 2 O1 -1.8525 -1.4781 -1.2114 O.co2 1 UNK -0.5442 3 O2 4.0510 -0.0382 -0.6028 O.3 1 UNK -0.5033 4 O3 -3.5500 -1.3470 0.2877 O.co2 1 UNK -0.5442 5 N -3.5526 1.3806 -0.0143 N.4 1 UNK 0.2251 6 C -1.3018 0.9726 0.8705 C.3 1 UNK 0.0210 7 C1 -2.2993 0.6704 -0.2586 C.3 1 UNK 0.0200 8 C2 0.1315 0.6987 0.4769 C.ar 1 UNK -0.0380 9 C3 0.6662 -0.5593 0.6993 C.ar 1 UNK -0.0131 10 C4 0.8815 1.7113 -0.0977 C.ar 1 UNK -0.0547 11 C5 1.9893 -0.8120 0.3367 C.ar 1 UNK 0.1585 12 C6 -2.6449 -0.8068 -0.3356 C.2 1 UNK 0.0897 13 C7 2.2044 1.4588 -0.4603 C.ar 1 UNK -0.0163 14 C8 2.7582 0.1972 -0.2433 C.ar 1 UNK 0.1582 15 H 1.9955 -2.7204 0.9430 H 1 UNK 0.2923 16 H1 4.4305 -0.8830 -0.4604 H 1 UNK 0.2923 17 H2 -3.3697 2.3823 0.0454 H 1 UNK 0.2001 18 H3 -3.9616 1.0568 0.8622 H 1 UNK 0.2001 19 H4 -4.2014 1.1985 -0.7800 H 1 UNK 0.2001 20 H5 -1.5466 0.3627 1.7149 H 1 UNK 0.0372 21 H6 -1.3792 2.0154 1.0972 H 1 UNK 0.0372 22 H7 -1.8324 0.9806 -1.1700 H 1 UNK 0.0918 23 H8 0.0921 -1.3017 1.1286 H 1 UNK 0.0658 24 H9 0.4660 2.6426 -0.2559 H 1 UNK 0.0621 25 H10 2.7734 2.2054 -0.8891 H 1 UNK 0.0655 @BOND 1 1 11 1 2 2 12 ar 3 3 14 1 4 4 12 ar 5 5 7 1 6 6 7 1 7 6 8 1 8 7 12 1 9 8 9 ar 10 8 10 ar 11 9 11 ar 12 10 13 ar 13 11 14 ar 14 13 14 ar 15 1 15 1 16 3 16 1 17 5 17 1 18 5 18 1 19 5 19 1 20 6 20 1 21 6 21 1 22 7 22 1 23 9 23 1 24 10 24 1 25 13 25 1