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	hartrees
Energy at 0K	-213.513420
Energy at 298.15K	-213.514762
HF Energy	-212.833050
Nuclear repulsion energy	67.827014

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3167	3003	25.71
2	A'	1934	1834	264.35
3	A'	1425	1351	1.80
4	A'	1148	1088	247.56
5	A'	694	658	21.31
6	A"	1078	1022	0.09

Atom	x (Å)	y (Å)
C1	0.000	0.396
O2	1.142	0.122
F3	-0.965	-0.526
H4	-0.446	1.383

	C1	O2	F3	H4
C1		1.1743	1.3355	1.0832
O2	1.1743		2.2047	2.0280
F3	1.3355	2.2047		1.9791
H4	1.0832	2.0280	1.9791

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	F3	122.788		O2	C1	H4	127.834
F3	C1	H4	109.378

All results from a given calculation for HFCO (formyl fluoride)

using model chemistry: CCSD=FULL/cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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