@MOLECULE (2z)-1-[5-(4-fluorobenzyl)-2-furyl]-3-hydroxy-3-(1h-1,2,4-triazol-3-yl)-2-propen-1-one 35 37 0 0 0 SMALL GASTEIGER @ATOM 1 F -5.2534 2.7961 1.4776 F 1 UNL1111111111 -0.1709 2 O -0.5136 -1.2957 -0.6932 O.2 1 UNL1111111111 -0.1649 3 O 2.1408 -2.6424 1.2170 O.2 1 UNL1111111111 -0.5236 4 O 4.1638 -1.0247 1.0857 O.2 1 UNL1111111111 -0.5037 5 N 5.3164 1.2857 0.2272 N.ar 1 UNL1111111111 -0.1765 6 N 3.4796 1.9413 -0.8512 N.ar 1 UNL1111111111 -0.3716 7 N 5.6187 2.4811 -0.3210 N.ar 1 UNL1111111111 -0.2467 8 C -2.6305 -0.9338 -1.7378 C.3 1 UNL1111111111 -0.2989 9 C -1.7779 -1.7999 -0.9035 C.ar 1 UNL1111111111 0.1751 10 C -3.3425 0.0686 -0.8736 C.ar 1 UNL1111111111 -0.0280 11 C -1.9390 -3.0003 -0.2538 C.ar 1 UNL1111111111 -0.2911 12 C 0.1354 -2.2131 0.1270 C.ar 1 UNL1111111111 -0.0694 13 C -0.6976 -3.2674 0.4137 C.ar 1 UNL1111111111 -0.0953 14 C -2.6017 1.0399 -0.1926 C.ar 1 UNL1111111111 -0.1176 15 C -4.7321 0.0256 -0.7511 C.ar 1 UNL1111111111 -0.1260 16 C 1.4988 -1.8786 0.4996 C.2 1 UNL1111111111 0.5297 17 C -3.2426 1.9747 0.6135 C.ar 1 UNL1111111111 -0.2121 18 C -5.3959 0.9525 0.0494 C.ar 1 UNL1111111111 -0.2134 19 C -4.6321 1.9090 0.7150 C.ar 1 UNL1111111111 0.1964 20 C 2.0726 -0.6341 0.0165 C.2 1 UNL1111111111 -0.4633 21 C 3.3409 -0.2811 0.3314 C.2 1 UNL1111111111 0.3991 22 C 4.0020 0.9466 -0.0948 C.ar 1 UNL1111111111 0.1175 23 C 4.4920 2.8755 -0.9786 C.ar 1 UNL1111111111 0.0694 24 H -3.3499 -1.5514 -2.3225 H 1 UNL1111111111 0.1746 25 H -2.0219 -0.4018 -2.5103 H 1 UNL1111111111 0.1847 26 H -2.8065 -3.6244 -0.2275 H 1 UNL1111111111 0.1780 27 H -0.4781 -4.1275 1.0185 H 1 UNL1111111111 0.1804 28 H -1.5136 1.0612 -0.2890 H 1 UNL1111111111 0.1730 29 H -5.3066 -0.7340 -1.2801 H 1 UNL1111111111 0.1569 30 H -2.6722 2.7325 1.1490 H 1 UNL1111111111 0.1786 31 H -6.4792 0.9256 0.1497 H 1 UNL1111111111 0.1739 32 H 1.4555 0.0163 -0.6075 H 1 UNL1111111111 0.2174 33 H 5.9972 0.7859 0.7726 H 1 UNL1111111111 0.3517 34 H 4.3919 3.7963 -1.5305 H 1 UNL1111111111 0.2076 35 H 3.6767 -1.8895 1.3926 H 1 UNL1111111111 0.4091 @BOND 1 1 19 1 2 2 9 ar 3 2 12 ar 4 3 16 2 5 4 21 1 6 4 35 1 7 5 7 ar 8 5 22 ar 9 5 33 1 10 6 22 ar 11 6 23 ar 12 7 23 ar 13 8 9 1 14 8 10 1 15 8 24 1 16 8 25 1 17 9 11 ar 18 10 14 ar 19 10 15 ar 20 11 13 ar 21 11 26 1 22 12 13 ar 23 12 16 1 24 13 27 1 25 14 17 ar 26 14 28 1 27 15 18 ar 28 15 29 1 29 16 20 1 30 17 19 ar 31 17 30 1 32 18 19 ar 33 18 31 1 34 20 21 2 35 20 32 1 36 21 22 1 37 23 34 1