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	hartrees
Energy at 0K	-186.500383
Energy at 298.15K	-186.501396
HF Energy	-186.500383
Nuclear repulsion energy	59.344088

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3134	2797	6.29
2	A'	1771	1581	38.19
3	A'	1385	1236	2.41
4	A'	1056	943	18.85
5	A'	456	407	12.03
6	A"	897	800	1.17

Atom	x (Å)	y (Å)
C1	0.000	0.387
H2	-0.361	1.459
O3	1.185	-0.015
O4	-1.140	-0.458

	C1	H2	O3	O4
C1		1.1314	1.2515	1.4188
H2	1.1314		2.1365	2.0690
O3	1.2515	2.1365		2.3667
O4	1.4188	2.0690	2.3667

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	O3	127.366		H2	C1	O4	107.924
O3	C1	O4	124.709

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

using model chemistry: B3LYP/STO-3G

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	0.130
2	H	0.082
3	O	-0.182
4	O	-0.029

	x	y	z	Total
	-1.083	0.914	0.000	1.417
CHELPG
AIM
ESP

	x	y	z
x	2.096	0.020	0.000
y	0.020	1.249	0.000
z	0.000	0.000	0.403

<r²>	35.752
(<r²>)^1/2	5.979