@MOLECULE FDBD03219 32 34 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0167 1.3828 0.0096 C.3 1 UNK -0.0524 2 C1 1.1646 2.0981 0.0022 C.3 1 UNK -0.0524 3 C2 2.3847 1.4387 -0.0147 C.3 1 UNK -0.0425 4 C3 2.4188 0.0505 -0.0242 C.3 1 UNK 0.0325 5 C4 1.2163 -0.6776 -0.0138 C.3 1 UNK 0.0325 6 C5 0.0021 -0.0041 0.0020 C.3 1 UNK -0.0425 7 C6 1.2743 -2.1506 -0.0194 C.2 1 UNK 0.1743 8 O 0.2402 -2.7897 -0.0065 O.2 1 UNK -0.2912 9 C7 2.5747 -2.8662 -0.0411 C.2 1 UNK 0.0687 10 C8 3.7285 -2.1675 -0.0548 C.2 1 UNK 0.0687 11 C9 3.6971 -0.6833 -0.0445 C.2 1 UNK 0.1743 12 O1 4.7426 -0.0631 -0.0525 O.2 1 UNK -0.2912 13 S 5.3201 -2.9141 -0.0862 S.3 1 UNK -0.1000 14 C10 5.0987 -4.4579 -0.8715 C.3 1 UNK 0.1212 15 C11 6.2124 -5.0177 -1.5765 C.1 1 UNK 0.0791 16 N 7.0958 -5.4617 -2.1358 N.1 1 UNK -0.1953 17 C12 3.9531 -5.1520 -0.8556 C.3 1 UNK 0.1212 18 C13 3.9189 -6.4065 -1.5453 C.1 1 UNK 0.0791 19 N1 3.8918 -7.4017 -2.0925 N.1 1 UNK -0.1953 20 S1 2.4987 -4.6230 -0.0459 S.3 1 UNK -0.1000 21 H -0.5486 1.6777 0.8899 H 1 UNK 0.0265 22 H1 -0.4508 1.6236 -0.9383 H 1 UNK 0.0265 23 H2 1.1585 2.7099 0.8800 H 1 UNK 0.0265 24 H3 1.1429 2.5903 -0.9476 H 1 UNK 0.0265 25 H4 2.9203 1.7558 0.8556 H 1 UNK 0.0272 26 H5 2.7967 1.7035 -0.9661 H 1 UNK 0.0272 27 H6 3.0845 0.8878 -0.0486 H 1 UNK 0.0388 28 H7 0.1640 -0.8714 -0.0232 H 1 UNK 0.0388 29 H8 -0.5368 -0.3165 -0.8680 H 1 UNK 0.0272 30 H9 -0.4129 -0.2631 0.9536 H 1 UNK 0.0272 31 H10 4.2642 -4.0355 -0.3517 H 1 UNK 0.0592 32 H11 3.9764 -4.2122 -0.3445 H 1 UNK 0.0592 @BOND 1 1 6 1 2 1 2 1 3 2 3 1 4 3 4 1 5 4 11 1 6 4 5 1 7 5 6 1 8 5 7 1 9 7 8 2 10 7 9 1 11 9 20 1 12 9 10 2 13 10 11 1 14 10 13 1 15 11 12 2 16 13 14 1 17 14 15 1 18 14 17 1 19 15 16 3 20 17 18 1 21 17 20 1 22 18 19 3 23 1 21 1 24 1 22 1 25 2 23 1 26 2 24 1 27 3 25 1 28 3 26 1 29 4 27 1 30 5 28 1 31 6 29 1 32 6 30 1 33 14 31 1 34 17 32 1