@MOLECULE FDBD02127 30 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.2849 0.7195 0.3352 C.3 1 UNK 0.0798 2 O -0.2528 -0.6999 0.1729 O.2 1 UNK -0.4829 3 C1 0.3703 -1.1810 -0.9372 C.2 1 UNK 0.2365 4 C2 0.9319 -0.3366 -1.8300 C.2 1 UNK 0.3685 5 O1 1.5474 -0.8037 -2.9249 O.2 1 UNK -0.2118 6 C3 1.6357 -2.1128 -3.1859 C.2 1 UNK 0.3481 7 C4 1.1028 -3.0260 -2.3489 C.2 1 UNK 0.0595 8 C5 0.4465 -2.5813 -1.1741 C.1 1 UNK -0.2055 9 O2 -0.0484 -3.3783 -0.3915 O.co2 1 UNK -0.7945 10 C6 2.3413 -2.5742 -4.4350 C.3 1 UNK 0.1208 11 S 1.1482 -2.6874 -5.7967 S.3 1 UNK -0.0275 12 P 0.8559 -0.6603 -6.3443 P.3 1 UNK 0.3913 13 O3 0.0093 -0.5939 -7.5565 O.2 1 UNK -0.2458 14 O4 0.1297 0.1219 -5.1390 O.3 1 UNK -0.3035 15 C7 -1.1962 -0.1821 -4.7010 C.3 1 UNK 0.0465 16 O5 2.2811 0.0247 -6.6469 O.3 1 UNK -0.3035 17 C8 3.1223 -0.3749 -7.7308 C.3 1 UNK 0.0465 18 H -0.7998 0.9634 1.2409 H 1 UNK 0.0660 19 H1 -0.7946 1.1620 -0.4951 H 1 UNK 0.0660 20 H2 0.7156 1.0959 0.3813 H 1 UNK 0.0660 21 H3 0.8863 0.6814 -1.6666 H 1 UNK 0.1807 22 H4 1.1718 -4.0337 -2.5606 H 1 UNK 0.0778 23 H5 2.7786 -3.5355 -4.2632 H 1 UNK 0.0519 24 H6 3.1087 -1.8737 -4.6905 H 1 UNK 0.0519 25 H7 -1.4619 0.4658 -3.8920 H 1 UNK 0.0529 26 H8 -1.2387 -1.1994 -4.3720 H 1 UNK 0.0529 27 H9 -1.8807 -0.0403 -5.5111 H 1 UNK 0.0529 28 H10 4.0114 0.2204 -7.7305 H 1 UNK 0.0529 29 H11 2.6017 -0.2379 -8.6555 H 1 UNK 0.0529 30 H12 3.3836 -1.4064 -7.6180 H 1 UNK 0.0529 @BOND 1 1 2 1 2 2 3 1 3 3 8 2 4 3 4 0 5 4 5 2 6 5 6 2 7 6 7 0 8 6 10 1 9 7 8 2 10 8 9 0 11 10 11 1 12 11 12 1 13 12 13 2 14 12 14 1 15 12 16 1 16 14 15 1 17 16 17 1 18 1 18 1 19 1 19 1 20 1 20 1 21 4 21 1 22 7 22 1 23 10 23 1 24 10 24 1 25 15 25 1 26 15 26 1 27 15 27 1 28 17 28 1 29 17 29 1 30 17 30 1