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	hartrees
Energy at 0K	-213.678895
Energy at 298.15K	-213.680129
Nuclear repulsion energy	64.726670

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3072	3049	32.80
2	A'	1735	1722	186.73
3	A'	1341	1331	1.78
4	A'	969	962	182.92
5	A'	596	591	15.77
6	A"	973	965	0.91

Atom	x (Å)	y (Å)
C1	0.000	0.422
O2	1.188	0.164
F3	-1.002	-0.584
H4	-0.491	1.405

	C1	O2	F3	H4
C1		1.2158	1.4193	1.0987
O2	1.2158		2.3142	2.0875
F3	1.4193	2.3142		2.0532
H4	1.0987	2.0875	2.0532

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	F3	122.669		O2	C1	H4	128.749
F3	C1	H4	108.582

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

using model chemistry: BLYP/6-31G

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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Number	Element	Mulliken
1	C	0.354
2	O	-0.271
3	F	-0.237
4	H	0.154

	x	y	z	Total
	-1.123	1.754	0.000	2.083
CHELPG
AIM
ESP

	x	y	z
x	2.887	0.072	0.000
y	0.072	1.882	0.000
z	0.000	0.000	0.975

<r²>	0.000
(<r²>)^1/2	0.000