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	hartrees
Energy at 0K	-213.745370
Energy at 298.15K	-213.746683
Nuclear repulsion energy	67.417045

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3103	2987	43.89
2	A'	1924	1852	285.23
3	A'	1390	1339	2.25
4	A'	1090	1050	259.74
5	A'	674	649	21.00
6	A"	1035	996	0.15

Atom	x (Å)	y (Å)
C1	0.000	0.396
O2	1.146	0.132
F3	-0.968	-0.536
H4	-0.461	1.391

	C1	O2	F3	H4
C1		1.1761	1.3432	1.0964
O2	1.1761		2.2171	2.0409
F3	1.3432	2.2171		1.9921
H4	1.0964	2.0409	1.9921

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	F3	123.154		O2	C1	H4	127.779
F3	C1	H4	109.067

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

using model chemistry: B3PW91/6-311G*

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	0.237
2	O	-0.254
3	F	-0.184
4	H	0.200

	x	y	z	Total
	-1.277	1.602	0.000	2.048
CHELPG
AIM
ESP

	x	y	z
x	2.728	-0.037	0.000
y	-0.037	1.914	0.000
z	0.000	0.000	1.216

<r²>	0.000
(<r²>)^1/2	0.000