@<TRIPOS>MOLECULE FDBD00020 15 14 0 0 0 SMALL GASTEIGER @<TRIPOS>ATOM 1 O 0.8765 -1.7477 0.4612 O.co2 1 UNK -0.5442 2 O1 -2.5468 0.2085 -1.0110 O.co2 1 UNK -0.5496 3 O2 2.0079 -0.5891 -1.1272 O.co2 1 UNK -0.5442 4 O3 -1.8021 -0.7792 0.8987 O.co2 1 UNK -0.5496 5 N 1.7445 1.6788 0.4055 N.4 1 UNK 0.2252 6 C 0.7272 0.6375 0.5499 C.3 1 UNK 0.0212 7 C1 -0.5957 1.1159 -0.0613 C.3 1 UNK 0.0353 8 C2 1.2748 -0.5980 -0.1470 C.2 1 UNK 0.0897 9 C3 -1.6864 0.0732 0.0312 C.2 1 UNK 0.0475 10 H 1.4228 2.5337 0.8594 H 1 UNK 0.2001 11 H1 1.9071 1.8602 -0.5850 H 1 UNK 0.2001 12 H2 2.6129 1.3685 0.8414 H 1 UNK 0.2001 13 H3 0.5201 0.4110 1.5749 H 1 UNK 0.0918 14 H4 -0.4322 1.3510 -1.0923 H 1 UNK 0.0384 15 H5 -0.9180 1.9736 0.4914 H 1 UNK 0.0384 @<TRIPOS>BOND 1 1 8 ar 2 2 9 ar 3 3 8 ar 4 4 9 ar 5 5 6 1 6 6 7 1 7 6 8 1 8 7 9 1 9 5 10 1 10 5 11 1 11 5 12 1 12 6 13 1 13 7 14 1 14 7 15 1