@MOLECULE FDBD02170 25 25 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0173 1.4248 0.0099 C.3 1 UNK 0.0464 2 O 0.0021 -0.0041 0.0020 O.3 1 UNK -0.3050 3 P -1.3361 -0.8992 0.0100 P.3 1 UNK 0.3609 4 S -2.5312 -0.2187 1.2675 S.2 1 UNK 0.0363 5 O1 -2.0146 -0.8632 -1.4496 O.3 1 UNK -0.3050 6 C1 -3.3564 -1.2890 -1.6949 C.3 1 UNK 0.0464 7 O2 -0.9633 -2.4184 0.3912 O.3 1 UNK -0.4261 8 C2 -2.0328 -3.1788 0.7387 C.ar 1 UNK 0.1297 9 C3 -2.4385 -3.2382 2.0665 C.ar 1 UNK -0.0183 10 C4 -3.5233 -4.0081 2.4235 C.ar 1 UNK -0.0409 11 C5 -4.2164 -4.7302 1.4481 C.ar 1 UNK 0.0520 12 C6 -3.8050 -4.6676 0.1139 C.ar 1 UNK -0.0409 13 C7 -2.7224 -3.8910 -0.2351 C.ar 1 UNK -0.0183 14 C8 -5.3446 -5.5324 1.8147 C.1 1 UNK 0.0992 15 N -6.2395 -6.1687 2.1056 N.1 1 UNK -0.1909 16 H 0.9865 1.7952 0.0023 H 1 UNK 0.0529 17 H1 -0.5181 1.7698 0.8903 H 1 UNK 0.0529 18 H2 -0.5349 1.7793 -0.8569 H 1 UNK 0.0529 19 H3 -3.5830 -1.1731 -2.7342 H 1 UNK 0.0529 20 H4 -4.0309 -0.6949 -1.1144 H 1 UNK 0.0529 21 H5 -3.4600 -2.3178 -1.4198 H 1 UNK 0.0529 22 H6 -1.9262 -2.7046 2.7861 H 1 UNK 0.0654 23 H7 -3.8239 -4.0517 3.4098 H 1 UNK 0.0631 24 H8 -4.3117 -5.2025 -0.6087 H 1 UNK 0.0631 25 H9 -2.4229 -3.8379 -1.2213 H 1 UNK 0.0654 @BOND 1 1 2 1 2 2 3 1 3 3 4 2 4 3 5 1 5 3 7 1 6 5 6 1 7 7 8 1 8 8 13 ar 9 8 9 ar 10 9 10 ar 11 10 11 ar 12 11 12 ar 13 11 14 1 14 12 13 ar 15 14 15 3 16 1 16 1 17 1 17 1 18 1 18 1 19 6 19 1 20 6 20 1 21 6 21 1 22 9 22 1 23 10 23 1 24 12 24 1 25 13 25 1