@MOLECULE FDBD03016 22 24 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0165 1.3620 0.0095 C.ar 1 UNK -0.0575 2 C1 1.1672 2.0858 0.0021 C.ar 1 UNK -0.0575 3 C2 2.3839 1.4361 -0.0130 C.ar 1 UNK -0.0110 4 C3 2.4230 0.0491 -0.0209 C.ar 1 UNK 0.1731 5 C4 1.2237 -0.6844 -0.0133 C.ar 1 UNK 0.1731 6 C5 0.0021 -0.0041 0.0020 C.ar 1 UNK -0.0110 7 N 1.5576 -1.9986 -0.0236 N.ar 1 UNK -0.2352 8 C6 2.8635 -2.1215 -0.0368 C.ar 1 UNK 0.3074 9 C7 3.5961 -3.4035 -0.0502 C.ar 1 UNK 0.1594 10 C8 2.9776 -4.6057 -0.0551 C.ar 1 UNK 0.0105 11 S 4.2217 -5.8529 -0.0713 S.2 1 UNK -0.0830 12 C9 5.4416 -4.6560 -0.0700 C.ar 1 UNK 0.0657 13 N1 4.9211 -3.4794 -0.0643 N.ar 1 UNK -0.2399 14 N2 3.4451 -0.8816 -0.0356 N.ar 1 UNK -0.2352 15 H -0.9200 1.8605 0.0208 H 1 UNK 0.0619 16 H1 1.1371 3.1173 0.0079 H 1 UNK 0.0619 17 H2 3.2614 1.9793 -0.0184 H 1 UNK 0.0661 18 H3 -0.8840 -0.5331 0.0076 H 1 UNK 0.0661 19 H4 0.9174 -2.7466 -0.0215 H 1 UNK 0.3114 20 H5 1.9579 -4.7645 -0.0502 H 1 UNK 0.0718 21 H6 6.4552 -4.8501 -0.0733 H 1 UNK 0.0907 22 H7 4.4106 -0.6891 -0.0437 H 1 UNK 0.3114 @BOND 1 1 6 ar 2 1 2 ar 3 2 3 ar 4 3 4 ar 5 4 14 ar 6 4 5 ar 7 5 6 ar 8 5 7 ar 9 7 8 ar 10 8 9 1 11 8 14 ar 12 9 13 ar 13 9 10 ar 14 10 11 ar 15 11 12 ar 16 12 13 ar 17 1 15 1 18 2 16 1 19 3 17 1 20 6 18 1 21 7 19 1 22 10 20 1 23 12 21 1 24 14 22 1