@MOLECULE FDBD03249 35 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0184 1.5028 0.0103 C.3 1 UNK 0.0332 2 C1 0.0021 -0.0041 0.0020 C.2 1 UNK 0.3040 3 O 1.0565 -0.5939 -0.0112 O.2 1 UNK -0.2512 4 O1 -1.1511 -0.6910 0.0093 O.3 1 UNK -0.4624 5 C2 -1.0555 -2.1398 0.0006 C.3 1 UNK 0.1233 6 C3 -2.4612 -2.7438 0.0108 C.3 1 UNK 0.1846 7 C4 -2.3614 -4.2660 0.1274 C.3 1 UNK 0.1581 8 C5 -3.7375 -4.8698 0.0141 C.ar 1 UNK -0.0049 9 C6 -4.2740 -5.1385 -1.2312 C.ar 1 UNK -0.0550 10 C7 -5.5362 -5.6923 -1.3352 C.ar 1 UNK -0.0614 11 C8 -6.2618 -5.9780 -0.1938 C.ar 1 UNK -0.0617 12 C9 -5.7250 -5.7101 1.0516 C.ar 1 UNK -0.0614 13 C10 -4.4610 -5.1603 1.1556 C.ar 1 UNK -0.0550 14 O2 -1.5186 -4.7788 -0.9380 O.3 1 UNK -0.4543 15 C11 -0.8256 -5.8994 -0.6810 C.2 1 UNK 0.3046 16 O3 -0.9202 -6.4340 0.3984 O.2 1 UNK -0.2511 17 C12 0.0702 -6.4906 -1.7388 C.3 1 UNK 0.0333 18 N -3.1522 -2.3935 -1.2326 N.pl3 1 UNK 0.0328 19 O4 -2.6903 -2.7411 -2.3047 O.2 1 UNK -0.1312 20 O5 -4.1885 -1.7547 -1.1942 O.2 1 UNK -0.1312 21 H 0.9854 1.8732 0.0027 H 1 UNK 0.0342 22 H1 -0.5193 1.8478 0.8906 H 1 UNK 0.0342 23 H2 -0.5359 1.8572 -0.8566 H 1 UNK 0.0342 24 H3 -0.5204 -2.4671 0.8674 H 1 UNK 0.0722 25 H4 -0.5371 -2.4577 -0.8798 H 1 UNK 0.0722 26 H5 -3.0094 -2.3574 0.8445 H 1 UNK 0.0670 27 H6 -1.9356 -4.5240 1.0745 H 1 UNK 0.0810 28 H7 -3.7321 -4.9256 -2.0833 H 1 UNK 0.0621 29 H8 -5.9369 -5.8925 -2.2649 H 1 UNK 0.0618 30 H9 -7.2042 -6.3913 -0.2714 H 1 UNK 0.0618 31 H10 -6.2679 -5.9206 1.9037 H 1 UNK 0.0618 32 H11 -4.0574 -4.9667 2.0855 H 1 UNK 0.0621 33 H12 0.0272 -5.8866 -2.6210 H 1 UNK 0.0342 34 H13 -0.2572 -7.4828 -1.9696 H 1 UNK 0.0342 35 H14 1.0767 -6.5222 -1.3769 H 1 UNK 0.0342 @BOND 1 1 2 1 2 2 3 2 3 2 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 6 18 1 8 7 8 1 9 7 14 1 10 8 13 ar 11 8 9 ar 12 9 10 ar 13 10 11 ar 14 11 12 ar 15 12 13 ar 16 14 15 1 17 15 16 2 18 15 17 1 19 18 19 2 20 18 20 2 21 1 21 1 22 1 22 1 23 1 23 1 24 5 24 1 25 5 25 1 26 6 26 1 27 7 27 1 28 9 28 1 29 10 29 1 30 11 30 1 31 12 31 1 32 13 32 1 33 17 33 1 34 17 34 1 35 17 35 1