@MOLECULE FDBD00951 47 48 0 0 0 SMALL GASTEIGER @ATOM 1 F -0.1418 -2.6904 -0.1559 F 1 UNK -0.1909 2 O -4.4218 -0.7029 1.0415 O.3 1 UNK -0.3123 3 O1 -4.3764 1.9686 -1.3502 O.3 1 UNK -0.3803 4 O2 -6.5698 1.1330 0.0387 O.3 1 UNK -0.3863 5 O3 -1.7747 2.3628 0.6155 O.2 1 UNK -0.1731 6 O4 3.8502 -0.3931 -0.0133 O.3 1 UNK -0.4322 7 O5 2.5348 1.4642 0.3002 O.2 1 UNK -0.2011 8 N -2.3602 0.1422 0.3343 N.am 1 UNK -0.0650 9 N1 -0.0554 0.9006 0.3368 N.am 1 UNK 0.0963 10 N2 1.6262 -0.6601 0.0466 N.am 1 UNK -0.1326 11 C -4.4150 0.6225 -0.9228 C.3 1 UNK 0.1722 12 C1 -5.8274 0.1402 -0.6689 C.3 1 UNK 0.1159 13 C2 -3.7643 0.4217 0.4350 C.3 1 UNK 0.2951 14 C3 -5.5989 -1.0345 0.2726 C.3 1 UNK 0.0912 15 C4 -5.3366 -2.3466 -0.4545 C.3 1 UNK -0.0359 16 C5 -1.9184 -1.1615 0.1345 C.2 1 UNK 0.2168 17 C6 -1.4088 1.1994 0.4383 C.2 1 UNK 0.6207 18 C7 -0.6255 -1.4530 0.0369 C.2 1 UNK 0.2744 19 C8 0.3039 -0.3274 0.1513 C.cat 1 UNK 0.3632 20 C9 7.5383 0.3737 -0.0812 C.3 1 UNK -0.0502 21 C10 6.2506 -0.4463 -0.1236 C.3 1 UNK -0.0184 22 C11 8.7669 -0.5089 -0.2990 C.3 1 UNK -0.0558 23 C12 5.0193 0.4314 0.0507 C.3 1 UNK 0.0962 24 C13 2.6560 0.2555 0.1276 C.2 1 UNK 0.4987 25 C14 10.0487 0.3088 -0.2912 C.3 1 UNK -0.0653 26 H -4.8024 2.0445 -2.2183 H 1 UNK 0.2103 27 H1 -6.7282 1.8935 -0.5422 H 1 UNK 0.2100 28 H2 1.8568 -1.6067 -0.0946 H 1 UNK 0.3049 29 H3 -3.9181 0.0998 -1.7132 H 1 UNK 0.0715 30 H4 -6.3616 -0.0901 -1.5670 H 1 UNK 0.0648 31 H5 -3.8624 1.3186 1.0102 H 1 UNK 0.1439 32 H6 -6.4782 -1.1809 0.8645 H 1 UNK 0.0622 33 H7 -4.4618 -2.2486 -1.0628 H 1 UNK 0.0255 34 H8 -6.1763 -2.5856 -1.0732 H 1 UNK 0.0255 35 H9 -5.1874 -3.1276 0.2616 H 1 UNK 0.0255 36 H10 -2.6123 -1.9218 0.0602 H 1 UNK 0.1406 37 H11 7.6166 0.8504 0.8736 H 1 UNK 0.0266 38 H12 7.5015 1.1005 -0.8657 H 1 UNK 0.0266 39 H13 6.2745 -1.1707 0.6635 H 1 UNK 0.0298 40 H14 6.1889 -0.9219 -1.0801 H 1 UNK 0.0298 41 H15 8.6762 -1.0043 -1.2431 H 1 UNK 0.0263 42 H16 8.8165 -1.2186 0.5003 H 1 UNK 0.0263 43 H17 5.0603 0.9237 0.9999 H 1 UNK 0.0699 44 H18 4.9864 1.1685 -0.7242 H 1 UNK 0.0699 45 H19 10.0191 1.0260 -1.0847 H 1 UNK 0.0230 46 H20 10.8873 -0.3413 -0.4291 H 1 UNK 0.0230 47 H21 10.1418 0.8172 0.6457 H 1 UNK 0.0230 @BOND 1 1 18 1 2 2 13 1 3 2 14 1 4 3 11 1 5 4 12 1 6 5 17 2 7 6 23 1 8 6 24 1 9 7 24 2 10 8 13 1 11 8 16 1 12 8 17 am 13 9 17 1 14 9 19 2 15 10 19 1 16 10 24 am 17 11 12 1 18 11 13 1 19 12 14 1 20 14 15 1 21 16 18 2 22 18 19 1 23 20 21 1 24 20 22 1 25 21 23 1 26 22 25 1 27 3 26 1 28 4 27 1 29 10 28 1 30 11 29 1 31 12 30 1 32 13 31 1 33 14 32 1 34 15 33 1 35 15 34 1 36 15 35 1 37 16 36 1 38 20 37 1 39 20 38 1 40 21 39 1 41 21 40 1 42 22 41 1 43 22 42 1 44 23 43 1 45 23 44 1 46 25 45 1 47 25 46 1 48 25 47 1