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	hartrees
Energy at 0K	-129.075139
Energy at 298.15K	-129.076218
HF Energy	-129.075139
Nuclear repulsion energy	27.266971

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3804	3456	52.29
2	A'	1302	1183	53.07
3	A'	1061	964	106.35

Atom	x (Å)	y (Å)
N1	0.058	0.813
O2	0.058	-0.598
H3	-0.863	-0.909

	N1	O2	H3
N1		1.4102	1.9521
O2	1.4102		0.9719
H3	1.9521	0.9719

Number	Element	Mulliken
1	N	0.159
2	O	-0.573
3	H	0.414

All results from a given calculation for NOH (Hydroxyimidogen)

using model chemistry: ROHF/3-21G*

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-2.027	-0.432	0.000	2.072
CHELPG
AIM
ESP

<r²>	15.811
(<r²>)^1/2	3.976