@MOLECULE FDBD01882 28 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0184 1.5028 0.0103 C.3 1 UNK -0.0212 2 C1 0.0021 -0.0041 0.0020 C.2 1 UNK 0.0789 3 N 0.0213 -0.6497 1.1066 N.2 1 UNK -0.0805 4 O 0.0231 -0.0465 2.1647 O.3 1 UNK -0.2991 5 C2 0.0439 -0.7857 3.2897 C.2 1 UNK 0.4257 6 O1 0.0597 -1.9988 3.2194 O.2 1 UNK -0.2241 7 N1 0.0470 -0.1804 4.4939 N.am 1 UNK -0.2824 8 C3 0.0696 -0.9848 5.7181 C.3 1 UNK 0.0033 9 C4 -0.0002 -0.7505 -1.3071 C.3 1 UNK 0.1145 10 C5 -1.4398 -0.9134 -1.7988 C.3 1 UNK -0.0375 11 S 0.9566 0.1803 -2.5355 S.O2 1 UNK -0.0260 12 O2 0.3487 1.4522 -2.7138 O.2 1 UNK -0.1740 13 O3 2.3320 0.1117 -2.1848 O.2 1 UNK -0.1740 14 C6 0.6936 -0.8017 -4.0379 C.3 1 UNK 0.0551 15 H 1.0042 1.8801 0.0026 H 1 UNK 0.0291 16 H1 -0.5455 1.8639 -0.8728 H 1 UNK 0.0291 17 H2 -0.5286 1.8543 0.9071 H 1 UNK 0.0291 18 H3 0.0344 0.7879 4.5500 H 1 UNK 0.1517 19 H4 0.0688 -0.3255 6.5861 H 1 UNK 0.0427 20 H5 -0.8115 -1.6258 5.7479 H 1 UNK 0.0427 21 H6 0.9682 -1.6015 5.7310 H 1 UNK 0.0427 22 H7 0.4489 -1.7335 -1.1657 H 1 UNK 0.0596 23 H8 -1.8889 0.0696 -1.9403 H 1 UNK 0.0252 24 H9 -1.4414 -1.4533 -2.7458 H 1 UNK 0.0252 25 H10 -2.0147 -1.4727 -1.0608 H 1 UNK 0.0252 26 H11 -0.3718 -0.8399 -4.2650 H 1 UNK 0.0464 27 H12 1.2264 -0.3420 -4.8703 H 1 UNK 0.0464 28 H13 1.0682 -1.8132 -3.8810 H 1 UNK 0.0464 @BOND 1 1 2 1 2 1 15 1 3 1 16 1 4 1 17 1 5 2 3 2 6 2 9 1 7 3 4 1 8 4 5 1 9 5 6 2 10 5 7 am 11 7 8 1 12 7 18 1 13 8 19 1 14 8 20 1 15 8 21 1 16 9 10 1 17 9 11 1 18 9 22 1 19 10 23 1 20 10 24 1 21 10 25 1 22 11 12 2 23 11 13 2 24 11 14 1 25 14 26 1 26 14 27 1 27 14 28 1