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	hartrees
Energy at 0K	-37.330349
Energy at 298.15K	-37.331623
HF Energy	-37.330349
Nuclear repulsion energy	33.188335

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3260	2974	23.11
2	A'	1819	1660	353.23
3	A'	1470	1342	5.51
4	A'	1106	1010	151.66
5	A'	614	561	56.39
6	A"	1092	996	0.21

Atom	x (Å)	y (Å)
C1	0.000	0.383
H2	-0.304	1.425
O3	1.138	-0.028
O4	-1.100	-0.437

	C1	H2	O3	O4
C1		1.0854	1.2101	1.3724
H2	1.0854		2.0468	2.0254
O3	1.2101	2.0468		2.2760
O4	1.3724	2.0254	2.2760

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	O3	126.079		H2	C1	O4	110.445
O3	C1	O4	123.477

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

using model chemistry: HF/CEP-121G

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	0.179
2	H	0.164
3	O	-0.252
4	O	-0.091

	x	y	z	Total
	-1.769	2.291	0.000	2.895
CHELPG
AIM
ESP

	x	y	z
x	3.173	-0.187	0.000
y	-0.187	2.004	0.000
z	0.000	0.000	1.212

<r²>	29.869
(<r²>)^1/2	5.465