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	hartrees
Energy at 0K	-189.021208
Energy at 298.15K	-189.022285
HF Energy	-189.021208
Nuclear repulsion energy	62.969477

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2555	2433	51.34
2	A'	1783	1698	155.42
3	A'	1146	1091	2.07
4	A'	959	913	113.23
5	A'	466	444	129.46
6	A"	881	839	0.23

Atom	x (Å)	y (Å)
C1	0.000	0.242
H2	-0.341	1.338
O3	1.172	-0.020
O4	-1.130	-0.328

	C1	H2	O3	O4
C1		1.1479	1.2013	1.2656
H2	1.1479		2.0337	1.8438
O3	1.2013	2.0337		2.3225
O4	1.2656	1.8438	2.3225

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	O3	119.902		H2	C1	O4	99.515
O3	C1	O4	140.583

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

using model chemistry: wB97X-D/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	0.364
2	H	0.202
3	O	-0.372
4	O	-0.194

	x	y	z	Total
	-1.018	1.596	0.000	1.893
CHELPG
AIM
ESP

	x	y	z
x	5.664	0.682	0.000
y	0.682	2.841	0.000
z	0.000	0.000	1.666

<r²>	35.045
(<r²>)^1/2	5.920