@MOLECULE FDBD01250 29 30 0 0 0 SMALL GASTEIGER @ATOM 1 S 0.7680 -0.6815 1.0889 S.2 1 UNK -0.0893 2 O 5.2075 1.4818 0.6267 O.co2 1 UNK -0.5492 3 O1 -1.9772 -2.4757 0.2560 O.2 1 UNK -0.2861 4 O2 3.3990 1.9068 -0.6712 O.co2 1 UNK -0.5492 5 C 3.4367 -0.1747 0.6060 C.3 1 UNK 0.0270 6 C1 2.1108 -0.5063 0.0408 C.ar 1 UNK -0.0013 7 C2 -0.2122 -1.0210 -0.2333 C.ar 1 UNK 0.0597 8 C3 1.7679 -0.7121 -1.2774 C.ar 1 UNK -0.0502 9 C4 4.5267 -1.2422 0.3482 C.3 1 UNK -0.0527 10 C5 0.3845 -1.0175 -1.4290 C.ar 1 UNK -0.0435 11 C6 -1.6548 -1.2977 0.0412 C.2 1 UNK 0.1997 12 C7 3.9866 1.1743 0.1143 C.2 1 UNK 0.0494 13 C8 -2.6598 -0.2470 0.0619 C.ar 1 UNK 0.0228 14 C9 -2.2907 1.0762 -0.1809 C.ar 1 UNK -0.0509 15 C10 -3.9931 -0.5621 0.3242 C.ar 1 UNK -0.0509 16 C11 -3.2548 2.0841 -0.1613 C.ar 1 UNK -0.0611 17 C12 -4.9571 0.4459 0.3437 C.ar 1 UNK -0.0611 18 C13 -4.5879 1.7690 0.1010 C.ar 1 UNK -0.0617 19 H 3.2365 -0.1303 1.6562 H 1 UNK 0.0411 20 H1 2.4346 -0.6521 -2.0628 H 1 UNK 0.0626 21 H2 4.7341 -1.2942 -0.7002 H 1 UNK 0.0239 22 H3 4.1810 -2.1950 0.6910 H 1 UNK 0.0239 23 H4 5.4188 -0.9756 0.8755 H 1 UNK 0.0239 24 H5 -0.0862 -1.2075 -2.3275 H 1 UNK 0.0630 25 H6 -1.3043 1.3094 -0.3750 H 1 UNK 0.0625 26 H7 -4.2663 -1.5409 0.5038 H 1 UNK 0.0625 27 H8 -2.9817 3.0630 -0.3409 H 1 UNK 0.0618 28 H9 -5.9435 0.2128 0.5377 H 1 UNK 0.0618 29 H10 -5.3012 2.5147 0.1155 H 1 UNK 0.0618 @BOND 1 1 6 ar 2 1 7 ar 3 2 12 ar 4 3 11 2 5 4 12 ar 6 5 6 1 7 5 9 1 8 5 12 1 9 6 8 ar 10 7 10 ar 11 7 11 1 12 8 10 ar 13 11 13 1 14 13 14 ar 15 13 15 ar 16 14 16 ar 17 15 17 ar 18 16 18 ar 19 17 18 ar 20 5 19 1 21 8 20 1 22 9 21 1 23 9 22 1 24 9 23 1 25 10 24 1 26 14 25 1 27 15 26 1 28 16 27 1 29 17 28 1 30 18 29 1