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	hartrees
Energy at 0K	-189.002757
Energy at 298.15K	-189.003855
HF Energy	-189.002757
Nuclear repulsion energy	62.497952

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2977	2835	30.71
2	A'	1824	1737	309.98
3	A'	1356	1291	10.43
4	A'	1064	1013	67.27
5	A'	418	398	40.39
6	A"	1010	962	0.00

Atom	x (Å)	y (Å)
C1	0.000	0.354
H2	-0.322	1.417
O3	1.130	-0.046
O4	-1.090	-0.397

	C1	H2	O3	O4
C1		1.1107	1.1989	1.3239
H2	1.1107		2.0610	1.9705
O3	1.1989	2.0610		2.2481
O4	1.3239	1.9705	2.2481

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	O3	126.304		H2	C1	O4	107.742
O3	C1	O4	125.954

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

using model chemistry: M06-2X/6-31+G**

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	0.342
2	H	0.165
3	O	-0.410
4	O	-0.097

	x	y	z	Total
	-1.609	1.738	0.000	2.368
CHELPG
AIM
ESP

	x	y	z
x	3.689	-0.034	0.000
y	-0.034	2.599	0.000
z	0.000	0.000	1.684

<r²>	34.553
(<r²>)^1/2	5.878