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	hartrees
Energy at 0K	-130.376651
Energy at 298.15K	-130.377690
HF Energy	-130.376651
Nuclear repulsion energy	27.306688

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3313	3288	9.58
2	A'	1142	1133	16.67
3	A'	925	918	139.55

Atom	x (Å)	y (Å)
N1	0.058	0.808
O2	0.058	-0.588
H3	-0.874	-0.952

	N1	O2	H3
N1		1.3967	1.9919
O2	1.3967		1.0010
H3	1.9919	1.0010

Number	Element	Mulliken
1	N	0.039
2	O	-0.428
3	H	0.388

All results from a given calculation for NOH (Hydroxyimidogen)

using model chemistry: BLYP/6-31G

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
	-1.991	-1.305	0.000	2.381
CHELPG
AIM
ESP

	x	y	z
x	1.244	0.360	0.000
y	0.360	2.444	0.000
z	0.000	0.000	0.655

<r²>	15.946
(<r²>)^1/2	3.993