@MOLECULE FDBD02101 26 25 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.4829 1.4932 0.2413 C.3 1 UNK -0.0306 2 C1 0.4362 -0.0359 0.2227 C.3 1 UNK 0.0897 3 O 0.9840 -0.5217 -1.0312 O.3 1 UNK -0.4643 4 C2 1.0157 -1.8519 -1.2077 C.2 1 UNK 0.3176 5 O1 0.5995 -2.5862 -0.3431 O.2 1 UNK -0.2499 6 C3 1.5704 -2.4296 -2.4843 C.3 1 UNK 0.1020 7 S 1.4761 -4.2400 -2.4198 S.3 1 UNK -0.0298 8 P -0.5713 -4.6252 -2.8120 P.3 1 UNK 0.3912 9 O2 -0.7801 -6.0833 -2.9568 O.2 1 UNK -0.2458 10 O3 -1.4646 -4.0739 -1.5912 O.3 1 UNK -0.3035 11 C4 -1.4128 -4.6298 -0.2758 C.3 1 UNK 0.0465 12 O4 -1.0059 -3.8830 -4.1730 O.3 1 UNK -0.3035 13 C5 -0.4703 -4.2271 -5.4523 C.3 1 UNK 0.0465 14 H 0.0792 1.8511 1.1653 H 1 UNK 0.0262 15 H1 -0.0950 1.8776 -0.5731 H 1 UNK 0.0262 16 H2 1.4971 1.8203 0.1447 H 1 UNK 0.0262 17 H3 -0.5780 -0.3630 0.3193 H 1 UNK 0.0694 18 H4 1.0141 -0.4203 1.0371 H 1 UNK 0.0694 19 H5 2.5912 -2.1294 -2.5977 H 1 UNK 0.0496 20 H6 0.9991 -2.0721 -3.3154 H 1 UNK 0.0496 21 H7 -2.0910 -4.1018 0.3615 H 1 UNK 0.0529 22 H8 -0.4187 -4.5413 0.1099 H 1 UNK 0.0529 23 H9 -1.6899 -5.6626 -0.3139 H 1 UNK 0.0529 24 H10 -0.9069 -3.6007 -6.2019 H 1 UNK 0.0529 25 H11 -0.6935 -5.2509 -5.6687 H 1 UNK 0.0529 26 H12 0.5905 -4.0873 -5.4442 H 1 UNK 0.0529 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 2 5 4 6 1 6 6 7 1 7 7 8 1 8 8 9 2 9 8 10 1 10 8 12 1 11 10 11 1 12 12 13 1 13 1 14 1 14 1 15 1 15 1 16 1 16 2 17 1 17 2 18 1 18 6 19 1 19 6 20 1 20 11 21 1 21 11 22 1 22 11 23 1 23 13 24 1 24 13 25 1 25 13 26 1