@MOLECULE FDBD03246 28 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0178 1.4608 0.0101 C.3 1 UNK 0.1404 2 N 0.0021 -0.0041 0.0020 N.am 1 UNK -0.1059 3 C1 0.0079 -0.7710 -1.1048 C.2 1 UNK 0.4000 4 O -0.0024 -0.3667 -2.2502 O.2 1 UNK -0.2179 5 C2 0.0294 -2.1839 -0.6893 C.3 1 UNK 0.1558 6 C3 0.0354 -2.1913 0.6693 C.3 1 UNK 0.1558 7 C4 0.0231 -0.7830 1.1003 C.2 1 UNK 0.4000 8 O1 0.0242 -0.3911 2.2501 O.2 1 UNK -0.2179 9 S 0.0613 -3.7190 1.5437 S.3 1 UNK -0.1221 10 C5 0.0794 -5.2369 0.6524 C.3 1 UNK 0.1558 11 C6 0.0733 -5.2295 -0.7061 C.3 1 UNK 0.1558 12 C7 0.0923 -6.6378 -1.1372 C.2 1 UNK 0.4000 13 O2 0.0937 -7.0296 -2.2871 O.2 1 UNK -0.2179 14 N1 0.1086 -7.4168 -0.0389 N.am 1 UNK -0.1059 15 C8 0.1303 -8.8816 -0.0470 C.3 1 UNK 0.1404 16 C9 0.1021 -6.6498 1.0679 C.2 1 UNK 0.4000 17 O3 0.1135 -7.0542 2.2133 O.2 1 UNK -0.2179 18 S1 0.0471 -3.7019 -1.5806 S.3 1 UNK -0.1221 19 H -0.0183 1.8119 1.0209 H 1 UNK 0.0988 20 H1 -0.8984 1.8083 -0.4887 H 1 UNK 0.0988 21 H2 0.8488 1.8321 -0.4960 H 1 UNK 0.0988 22 H3 0.0300 -2.6087 -1.6713 H 1 UNK 0.0576 23 H4 0.0264 -2.6267 1.6467 H 1 UNK 0.0576 24 H5 0.0764 -4.8120 1.6344 H 1 UNK 0.0576 25 H6 0.0617 -4.7940 -1.6834 H 1 UNK 0.0576 26 H7 0.1311 -9.2327 -1.0578 H 1 UNK 0.0988 27 H8 -0.7357 -9.2539 0.4593 H 1 UNK 0.0988 28 H9 1.0114 -9.2280 0.4516 H 1 UNK 0.0988 @BOND 1 1 2 1 2 2 7 am 3 2 3 am 4 3 4 2 5 3 5 1 6 5 18 1 7 5 6 1 8 6 7 1 9 6 9 1 10 7 8 2 11 9 10 1 12 10 16 1 13 10 11 1 14 11 12 1 15 11 18 1 16 12 13 2 17 12 14 am 18 14 15 1 19 14 16 am 20 16 17 2 21 1 19 1 22 1 20 1 23 1 21 1 24 5 22 1 25 6 23 1 26 10 24 1 27 11 25 1 28 15 26 1 29 15 27 1 30 15 28 1