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	hartrees
Energy at 0K	-188.147953
Energy at 298.15K	-188.149252
HF Energy	-188.147953
Nuclear repulsion energy	63.403141

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3171	2871	37.99
2	A'	2004	1815	365.96
3	A'	1502	1360	15.00
4	A'	1180	1069	118.41
5	A'	634	574	46.30
6	A"	1158	1049	3.24

Atom	x (Å)	y (Å)
C1	0.000	0.358
H2	-0.325	1.403
O3	1.107	-0.024
O4	-1.066	-0.420

	C1	H2	O3	O4
C1		1.0936	1.1712	1.3204
H2	1.0936		2.0211	1.9682
O3	1.1712	2.0211		2.2093
O4	1.3204	1.9682	2.2093

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	O3	126.320		H2	C1	O4	108.870
O3	C1	O4	124.810

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

using model chemistry: HF/6-31G(2df,p)

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	0.382
2	H	0.160
3	O	-0.363
4	O	-0.178

	x	y	z	Total
	-1.699	1.690	0.000	2.396
CHELPG
AIM
ESP

	x	y	z
x	2.874	-0.089	0.000
y	-0.089	2.218	0.000
z	0.000	0.000	1.533

<r²>	33.519
(<r²>)^1/2	5.790