@MOLECULE FDBF02158 16 15 0 0 0 SMALL GASTEIGER @ATOM 1 N1 5.5950 1.8830 1.0910 N.3 1 FRG1 -0.1976 2 C4 4.6730 2.6340 1.9610 C.3 1 FRG1 0.0055 3 S1 5.0090 1.2440 -0.3830 S.O2 1 FRG1 0.0289 4 O2 5.9780 0.3050 -0.9240 O.2 1 FRG1 -0.1582 5 O3 4.5260 2.3480 -1.1960 O.2 1 FRG1 -0.1582 6 C1 2.8630 -0.3670 -0.9610 C.3 1 FRG1 -0.0443 7 C1 3.6050 0.3330 0.1800 C.3 1 FRG1 0.0789 8 H 6.3652 2.5104 0.8595 H 1 FRG1 0.1473 9 H 3.8466 2.0092 2.2285 H 1 FRG1 0.0405 10 H 4.3139 3.4967 1.4398 H 1 FRG1 0.0405 11 H 5.1890 2.9414 2.8465 H 1 FRG1 0.0405 12 H 2.0247 -0.9020 -0.5661 H 1 FRG1 0.0246 13 H 3.5246 -1.0512 -1.4499 H 1 FRG1 0.0246 14 H 2.5209 0.3628 -1.6647 H 1 FRG1 0.0246 15 H 3.9342 -0.4066 0.8797 H 1 FRG1 0.0513 16 H 2.9268 1.0273 0.6304 H 1 FRG1 0.0513 @BOND 1 5 3 2 2 6 7 1 3 4 3 2 4 3 7 1 5 3 1 1 6 1 2 1 7 1 8 1 8 2 9 1 9 2 10 1 10 2 11 1 11 6 12 1 12 6 13 1 13 6 14 1 14 7 15 1 15 7 16 1