@MOLECULE flufenacet 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.2890 -1.4244 -0.0069 S.2 1 UNL111111111 0.3161 2 F 4.1293 4.1043 0.0077 F 1 UNL111111111 -0.1628 3 F -5.6921 1.8281 -0.1079 F 1 UNL111111111 -0.1566 4 F -6.0361 -0.0375 -1.0363 F 1 UNL111111111 -0.1904 5 F -6.0329 0.1062 1.0691 F 1 UNL111111111 -0.1884 6 O -0.5967 -1.3970 0.0522 O.3 1 UNL111111111 -0.1884 7 O 1.4552 -2.9178 0.0326 O.2 1 UNL111111111 -0.4804 8 N 3.0132 -1.2785 -0.0145 N.am 1 UNL111111111 -0.5316 9 N -1.7540 0.6962 0.0513 N.ar 1 UNL111111111 -0.3072 10 N -2.9968 1.1618 0.0326 N.ar 1 UNL111111111 -0.0303 11 C 4.1387 -2.2423 -0.0484 C.3 1 UNL111111111 0.1540 12 C 3.3081 0.1187 -0.0068 C.ar 1 UNL111111111 0.1305 13 C 5.0086 -2.0933 1.2066 C.3 1 UNL111111111 -0.4826 14 C 4.9766 -2.0391 -1.3175 C.3 1 UNL111111111 -0.4818 15 C 1.7085 -1.7348 0.0300 C.2 1 UNL111111111 0.5621 16 C 0.6408 -0.6493 0.0722 C.3 1 UNL111111111 -0.1533 17 C 3.4842 0.7824 1.2148 C.ar 1 UNL111111111 -0.1444 18 C 3.4077 0.8070 -1.2235 C.ar 1 UNL111111111 -0.1432 19 C 3.7644 2.1443 1.2258 C.ar 1 UNL111111111 -0.2002 20 C 3.6874 2.1694 -1.2248 C.ar 1 UNL111111111 -0.2000 21 C 3.8611 2.8084 0.0028 C.ar 1 UNL111111111 0.1974 22 C -1.6873 -0.6492 0.0369 C.ar 1 UNL111111111 0.1867 23 C -3.9366 0.2248 0.0009 C.ar 1 UNL111111111 -0.2477 24 C -5.3918 0.5372 -0.0188 C.3 1 UNL111111111 0.5657 25 H 3.6892 -3.2781 -0.0650 H 1 UNL111111111 0.1697 26 H 5.7934 -2.8585 1.2255 H 1 UNL111111111 0.1569 27 H 5.5022 -1.1161 1.2512 H 1 UNL111111111 0.1547 28 H 4.4144 -2.2111 2.1205 H 1 UNL111111111 0.1572 29 H 4.3616 -2.1300 -2.2205 H 1 UNL111111111 0.1571 30 H 5.7685 -2.7945 -1.3822 H 1 UNL111111111 0.1569 31 H 5.4591 -1.0555 -1.3388 H 1 UNL111111111 0.1550 32 H 0.6879 -0.0439 0.9988 H 1 UNL111111111 0.1812 33 H 0.6825 0.0243 -0.8068 H 1 UNL111111111 0.1823 34 H 3.4020 0.2299 2.1516 H 1 UNL111111111 0.1726 35 H 3.2668 0.2731 -2.1642 H 1 UNL111111111 0.1730 36 H 3.9015 2.6757 2.1675 H 1 UNL111111111 0.1801 37 H 3.7650 2.7199 -2.1623 H 1 UNL111111111 0.1803 @BOND 1 1 22 ar 2 1 23 ar 3 2 21 1 4 3 24 1 5 4 24 1 6 5 24 1 7 6 16 1 8 6 22 1 9 7 15 2 10 8 11 1 11 8 12 1 12 8 15 am 13 9 10 ar 14 9 22 ar 15 10 23 ar 16 11 13 1 17 11 14 1 18 11 25 1 19 12 17 ar 20 12 18 ar 21 13 26 1 22 13 27 1 23 13 28 1 24 14 29 1 25 14 30 1 26 14 31 1 27 15 16 1 28 16 32 1 29 16 33 1 30 17 19 ar 31 17 34 1 32 18 20 ar 33 18 35 1 34 19 21 ar 35 19 36 1 36 20 21 ar 37 20 37 1 38 23 24 1