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	hartrees
Energy at 0K	-188.981128
Energy at 298.15K	-188.982390
HF Energy	-188.981128
Nuclear repulsion energy	63.357072

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2969	2969	42.53
2	A'	1445	1445	52.15
3	A'	1334	1334	12.05
4	A'	1222	1222	39.99
5	A'	630	630	20.46
6	A"	992	992	0.34

Atom	x (Å)	y (Å)
C1	0.000	0.436
H2	-0.001	1.541
O3	-1.051	-0.260
O4	1.051	-0.260

	C1	H2	O3	O4
C1		1.1051	1.2601	1.2606
H2	1.1051		2.0845	2.0860
O3	1.2601	2.0845		2.1014
O4	1.2606	2.0860	2.1014

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	O3	123.468		H2	C1	O4	123.580
O3	C1	O4	112.952

All results from a given calculation for HCOO (formate neutral radical)

using model chemistry: PBEPBE/cc-pVQZ

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	0.446
2	H	0.023
3	O	-0.234
4	O	-0.235

	x	y	z	Total
	-0.001	2.235	0.000	2.235
CHELPG
AIM
ESP

<r²>	32.635
(<r²>)^1/2	5.713