@MOLECULE FDBD03020 29 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0187 1.5258 0.0104 C.3 1 UNK -0.0468 2 C1 0.0021 -0.0041 0.0020 C.3 1 UNK 0.0189 3 C2 0.7421 -0.5109 1.2415 C.3 1 UNK -0.0468 4 N -1.3723 -0.5112 0.0124 N.am 1 UNK -0.2968 5 C3 -1.6432 -1.7342 -0.4849 C.2 1 UNK 0.3055 6 O -0.7469 -2.4166 -0.9421 O.2 1 UNK -0.2524 7 N1 -2.9076 -2.2007 -0.4753 N.am 1 UNK -0.2485 8 C4 -3.1859 -3.4576 -0.9864 C.ar 1 UNK 0.1666 9 N2 -2.3100 -4.2585 -1.4866 N.ar 1 UNK -0.2245 10 C5 -2.7355 -5.4523 -1.9447 C.ar 1 UNK 0.0803 11 C6 -1.9834 -6.4926 -2.5309 C.ar 1 UNK -0.0351 12 C7 -2.5979 -7.6482 -2.9413 C.ar 1 UNK -0.0597 13 C8 -3.9668 -7.8133 -2.7877 C.ar 1 UNK -0.0606 14 C9 -4.7211 -6.8118 -2.2184 C.ar 1 UNK -0.0458 15 C10 -4.1139 -5.6317 -1.7954 C.ar 1 UNK 0.0408 16 S -4.7837 -4.1891 -1.0374 S.2 1 UNK -0.0520 17 H 1.0039 1.9031 0.0027 H 1 UNK 0.0247 18 H1 -0.5459 1.8868 -0.8726 H 1 UNK 0.0247 19 H2 -0.5289 1.8773 0.9072 H 1 UNK 0.0247 20 H3 0.5123 -0.3556 -0.8948 H 1 UNK 0.0493 21 H4 0.2319 -0.1594 2.1383 H 1 UNK 0.0247 22 H5 0.7568 -1.6008 1.2356 H 1 UNK 0.0247 23 H6 1.7647 -0.1336 1.2338 H 1 UNK 0.0247 24 H7 -2.0874 0.0333 0.3772 H 1 UNK 0.1505 25 H8 -3.6227 -1.6562 -0.1105 H 1 UNK 0.1583 26 H9 -0.9170 -6.3779 -2.6575 H 1 UNK 0.0639 27 H10 -2.0108 -8.4368 -3.3884 H 1 UNK 0.0618 28 H11 -4.4408 -8.7269 -3.1149 H 1 UNK 0.0618 29 H12 -5.7866 -6.9417 -2.0994 H 1 UNK 0.0629 @BOND 1 1 2 1 2 1 17 1 3 1 18 1 4 1 19 1 5 2 3 1 6 2 4 1 7 2 20 1 8 3 21 1 9 3 22 1 10 3 23 1 11 4 5 am 12 4 24 1 13 5 6 2 14 5 7 am 15 7 8 1 16 7 25 1 17 8 16 ar 18 8 9 ar 19 9 10 ar 20 10 15 ar 21 10 11 ar 22 11 12 ar 23 11 26 1 24 12 13 ar 25 12 27 1 26 13 14 ar 27 13 28 1 28 14 15 ar 29 14 29 1 30 15 16 ar