@MOLECULE FDBD02965 41 42 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0187 1.5258 0.0104 C.3 1 UNK -0.0605 2 C1 0.0021 -0.0041 0.0020 C.3 1 UNK -0.0196 3 C2 -1.4333 -0.5336 0.0129 C.3 1 UNK -0.0605 4 C3 0.7182 -0.4975 -1.2568 C.3 1 UNK 0.1048 5 H 1.7408 -0.1202 -1.2645 H 1 UNK 0.0598 6 C4 0.7387 -2.0043 -1.2651 C.2 1 UNK 0.2342 7 O 0.2131 -2.6129 -2.1730 O.2 1 UNK -0.2738 8 N 1.3410 -2.6756 -0.2635 N.am 1 UNK -0.3052 9 C5 1.3608 -4.1405 -0.2716 C.3 1 UNK 0.0690 10 H1 1.4455 -4.4970 -1.2981 H 1 UNK 0.0566 11 C6 0.0664 -4.6715 0.3476 C.3 1 UNK -0.0405 12 C7 2.5391 -4.6313 0.5295 C.ar 1 UNK 0.0994 13 N1 2.8715 -4.1716 1.6759 N.ar 1 UNK -0.2421 14 C8 3.9509 -4.7061 2.2792 C.ar 1 UNK 0.0787 15 C9 4.5316 -4.3942 3.5252 C.ar 1 UNK -0.0325 16 C10 5.6373 -5.0609 3.9577 C.ar 1 UNK -0.0244 17 C11 6.2137 -6.0597 3.1820 C.ar 1 UNK 0.1246 18 C12 5.6663 -6.3856 1.9595 C.ar 1 UNK -0.0106 19 C13 4.5352 -5.7123 1.5024 C.ar 1 UNK 0.0420 20 S 3.5926 -5.8749 0.0240 S.2 1 UNK -0.0702 21 F 7.3109 -6.7111 3.6259 F 1 UNK -0.2055 22 N2 0.0097 -0.0122 -2.4437 N.am 1 UNK -0.2697 23 C14 0.2742 1.2162 -2.9311 C.2 1 UNK 0.3985 24 O1 1.1004 1.9211 -2.3862 O.2 1 UNK -0.2266 25 O2 -0.3770 1.6622 -4.0219 O.3 1 UNK -0.4663 26 H2 1.0039 1.9031 0.0027 H 1 UNK 0.0233 27 H3 -0.5459 1.8868 -0.8726 H 1 UNK 0.0233 28 H4 -0.5289 1.8773 0.9072 H 1 UNK 0.0233 29 H5 0.5293 -0.3651 0.8851 H 1 UNK 0.0318 30 H6 -1.9605 -0.1726 -0.8702 H 1 UNK 0.0233 31 H7 -1.4185 -1.6235 0.0069 H 1 UNK 0.0233 32 H8 -1.9435 -0.1821 0.9097 H 1 UNK 0.0233 33 H9 1.7613 -2.1889 0.4626 H 1 UNK 0.1494 34 H10 -0.0183 -4.3149 1.3741 H 1 UNK 0.0251 35 H11 -0.7859 -4.3165 -0.2319 H 1 UNK 0.0251 36 H12 0.0812 -5.7614 0.3416 H 1 UNK 0.0251 37 H13 4.0967 -3.6208 4.1410 H 1 UNK 0.0640 38 H14 6.0715 -4.8104 4.9144 H 1 UNK 0.0647 39 H15 6.1137 -7.1619 1.3566 H 1 UNK 0.0658 40 H16 -0.6499 -0.5749 -2.8787 H 1 UNK 0.1528 41 H17 -0.1535 2.5496 -4.3343 H 1 UNK 0.2968 @BOND 1 1 2 1 2 1 26 1 3 1 27 1 4 1 28 1 5 2 3 1 6 2 4 1 7 2 29 1 8 3 30 1 9 3 31 1 10 3 32 1 11 4 5 1 12 4 6 1 13 4 22 1 14 6 7 2 15 6 8 am 16 8 9 1 17 8 33 1 18 9 10 1 19 9 11 1 20 9 12 1 21 11 34 1 22 11 35 1 23 11 36 1 24 12 20 ar 25 12 13 ar 26 13 14 ar 27 14 19 ar 28 14 15 ar 29 15 16 ar 30 15 37 1 31 16 17 ar 32 16 38 1 33 17 18 ar 34 17 21 1 35 18 19 ar 36 18 39 1 37 19 20 ar 38 22 23 am 39 22 40 1 40 23 24 2 41 23 25 1 42 25 41 1