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	hartrees
Energy at 0K	-213.640916
Energy at 298.15K	-213.642201
Nuclear repulsion energy	65.862085

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3191	3043	25.47
2	A'	1833	1748	223.13
3	A'	1394	1330	2.24
4	A'	1057	1008	206.78
5	A'	634	605	21.31
6	A"	1025	977	0.20

Atom	x (Å)	y (Å)
C1	0.000	0.414
O2	1.170	0.145
F3	-0.988	-0.560
H4	-0.466	1.398

	C1	O2	F3	H4
C1		1.2004	1.3875	1.0882
O2	1.2004		2.2700	2.0604
F3	1.3875	2.2700		2.0260
H4	1.0882	2.0604	2.0260

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	F3	122.434		O2	C1	H4	128.320
F3	C1	H4	109.246

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

using model chemistry: B1B95/6-31G

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	0.404
2	O	-0.311
3	F	-0.281
4	H	0.187

	x	y	z	Total
	-1.193	1.933	0.000	2.271
CHELPG
AIM
ESP

	x	y	z
x	2.751	0.012	0.000
y	0.012	1.747	0.000
z	0.000	0.000	0.952

<r²>	0.000
(<r²>)^1/2	0.000