@MOLECULE efinaconazole 47 49 0 0 0 SMALL GASTEIGER @ATOM 1 F 1.1288 0.9646 2.0613 F 1 UNL1111111111 -0.1576 2 F 4.8965 2.5410 -0.1548 F 1 UNL1111111111 -0.1587 3 O -0.2271 -0.6416 -1.6404 O.3 1 UNL1111111111 -0.5798 4 N -2.4135 -0.0492 0.4020 N.3 1 UNL1111111111 -0.4577 5 N 1.1994 -2.1638 0.2956 N.ar 1 UNL1111111111 -0.1471 6 N 2.1313 -2.2875 1.2788 N.ar 1 UNL1111111111 -0.2820 7 N 2.9343 -3.1683 -0.6539 N.ar 1 UNL1111111111 -0.4251 8 C -1.2582 0.8017 0.0511 C.3 1 UNL1111111111 0.0207 9 C -0.0516 -0.1218 -0.3348 C.3 1 UNL1111111111 0.2804 10 C -3.1216 -0.6714 -0.7329 C.3 1 UNL1111111111 -0.0893 11 C -3.3272 0.6573 1.3372 C.3 1 UNL1111111111 -0.0872 12 C -0.0299 -1.4215 0.5209 C.3 1 UNL1111111111 -0.0852 13 C -4.3936 0.0736 -1.1814 C.3 1 UNL1111111111 -0.3402 14 C -4.7438 0.0584 1.3166 C.3 1 UNL1111111111 -0.3113 15 C -1.4978 1.8512 -1.0440 C.3 1 UNL1111111111 -0.4929 16 C 1.2592 0.6286 -0.2664 C.ar 1 UNL1111111111 -0.1985 17 C -5.3573 0.2029 -0.0418 C.2 1 UNL1111111111 0.0663 18 C 1.7941 1.1207 0.9297 C.ar 1 UNL1111111111 0.2492 19 C 2.0240 0.7906 -1.4264 C.ar 1 UNL1111111111 -0.0573 20 C -6.6592 0.4287 -0.2255 C.2 1 UNL1111111111 -0.4018 21 C 3.0217 1.7772 1.0062 C.ar 1 UNL1111111111 -0.2927 22 C 3.2544 1.4405 -1.4039 C.ar 1 UNL1111111111 -0.2538 23 C 1.6992 -2.6879 -0.8932 C.ar 1 UNL1111111111 0.0946 24 C 3.7279 1.9229 -0.1844 C.ar 1 UNL1111111111 0.2473 25 C 3.1814 -2.9130 0.6907 C.ar 1 UNL1111111111 0.0630 26 H -0.9768 1.3544 0.9893 H 1 UNL1111111111 0.1576 27 H -3.4007 -1.6982 -0.3912 H 1 UNL1111111111 0.1470 28 H -2.4354 -0.8144 -1.5935 H 1 UNL1111111111 0.1506 29 H -3.3924 1.7464 1.1251 H 1 UNL1111111111 0.1194 30 H -2.8833 0.5416 2.3534 H 1 UNL1111111111 0.1448 31 H -0.9006 -2.0641 0.2291 H 1 UNL1111111111 0.1895 32 H -0.1629 -1.1932 1.6047 H 1 UNL1111111111 0.1967 33 H -4.8565 -0.4589 -2.0350 H 1 UNL1111111111 0.1551 34 H -4.1373 1.0822 -1.5632 H 1 UNL1111111111 0.1552 35 H -5.3627 0.5427 2.0966 H 1 UNL1111111111 0.1512 36 H -4.7055 -1.0181 1.5931 H 1 UNL1111111111 0.1687 37 H -1.8420 1.4107 -1.9853 H 1 UNL1111111111 0.1490 38 H -2.2684 2.5679 -0.7328 H 1 UNL1111111111 0.1573 39 H -0.5868 2.4284 -1.2461 H 1 UNL1111111111 0.1606 40 H -0.4071 0.0645 -2.2951 H 1 UNL1111111111 0.3284 41 H 1.6709 0.3794 -2.3766 H 1 UNL1111111111 0.1689 42 H -7.3681 0.5367 0.5781 H 1 UNL1111111111 0.1528 43 H -7.1194 0.5221 -1.1949 H 1 UNL1111111111 0.1523 44 H 3.4136 2.1424 1.9559 H 1 UNL1111111111 0.1994 45 H 3.8376 1.5525 -2.3174 H 1 UNL1111111111 0.1842 46 H 1.1618 -2.6973 -1.8270 H 1 UNL1111111111 0.2084 47 H 4.0953 -3.1874 1.1881 H 1 UNL1111111111 0.1999 @BOND 1 1 18 1 2 2 24 1 3 3 9 1 4 3 40 1 5 4 8 1 6 4 10 1 7 4 11 1 8 5 6 ar 9 5 12 1 10 5 23 ar 11 6 25 ar 12 7 23 ar 13 7 25 ar 14 8 9 1 15 8 15 1 16 8 26 1 17 9 12 1 18 9 16 1 19 10 13 1 20 10 27 1 21 10 28 1 22 11 14 1 23 11 29 1 24 11 30 1 25 12 31 1 26 12 32 1 27 13 17 1 28 13 33 1 29 13 34 1 30 14 17 1 31 14 35 1 32 14 36 1 33 15 37 1 34 15 38 1 35 15 39 1 36 16 18 ar 37 16 19 ar 38 17 20 2 39 18 21 ar 40 19 22 ar 41 19 41 1 42 20 42 1 43 20 43 1 44 21 24 ar 45 21 44 1 46 22 24 ar 47 22 45 1 48 23 46 1 49 25 47 1