@MOLECULE FDBD02098 30 29 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.3420 1.9602 0.1520 C.3 1 UNK -0.0536 2 C1 -0.2142 0.4357 0.1677 C.3 1 UNK -0.0004 3 C2 0.4870 -0.0041 1.4546 C.3 1 UNK -0.0536 4 S -1.8660 -0.3104 0.0939 S.3 1 UNK -0.1571 5 C3 -2.4681 0.1925 -1.5417 C.3 1 UNK 0.0034 6 C4 -3.8750 -0.3673 -1.7615 C.3 1 UNK 0.0112 7 S1 -4.4771 0.1356 -3.3971 S.3 1 UNK -0.0731 8 P -3.4167 -1.1468 -4.7107 P.3 1 UNK 0.2287 9 S2 -4.0516 -0.9192 -6.4479 S.2 1 UNK 0.0032 10 O -1.8481 -0.7876 -4.6612 O.3 1 UNK -0.3267 11 C5 -1.3539 0.5516 -4.7264 C.3 1 UNK 0.0441 12 O1 -3.6316 -2.6765 -4.2569 O.3 1 UNK -0.3267 13 C6 -4.8468 -3.3928 -4.4854 C.3 1 UNK 0.0441 14 H 0.6323 2.4003 0.1955 H 1 UNK 0.0240 15 H1 -0.9153 2.2788 0.9974 H 1 UNK 0.0240 16 H2 -0.8324 2.2678 -0.7479 H 1 UNK 0.0240 17 H3 0.3592 0.1172 -0.6777 H 1 UNK 0.0407 18 H4 -0.0864 0.3145 2.3000 H 1 UNK 0.0240 19 H5 1.4613 0.4360 1.4982 H 1 UNK 0.0240 20 H6 0.5764 -1.0703 1.4656 H 1 UNK 0.0240 21 H7 -1.8112 -0.1875 -2.2960 H 1 UNK 0.0384 22 H8 -2.4963 1.2606 -1.5985 H 1 UNK 0.0384 23 H9 -4.5319 0.0127 -1.0072 H 1 UNK 0.0389 24 H10 -3.8468 -1.4354 -1.7047 H 1 UNK 0.0389 25 H11 -0.2852 0.5402 -4.6758 H 1 UNK 0.0528 26 H12 -1.7439 1.1161 -3.9053 H 1 UNK 0.0528 27 H13 -1.6626 1.0013 -5.6469 H 1 UNK 0.0528 28 H14 -4.7535 -4.3861 -4.0986 H 1 UNK 0.0528 29 H15 -5.0430 -3.4363 -5.5364 H 1 UNK 0.0528 30 H16 -5.6539 -2.8924 -3.9923 H 1 UNK 0.0528 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 4 5 1 5 5 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 3 18 1 18 3 19 1 19 3 20 1 20 5 21 1 21 5 22 1 22 6 23 1 23 6 24 1 24 11 25 1 25 11 26 1 26 11 27 1 27 13 28 1 28 13 29 1 29 13 30 1