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	hartrees
Energy at 0K	-130.412655
Energy at 298.15K	-130.413745
HF Energy	-130.412655
Nuclear repulsion energy	28.811891

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3715	3715	93.76
2	A'	1267	1267	30.29
3	A'	1154	1154	173.71

Atom	x (Å)	y (Å)
N1	0.058	0.761
O2	0.058	-0.557
H3	-0.863	-0.872

	N1	O2	H3
N1		1.3178	1.8752
O2	1.3178		0.9735
H3	1.8752	0.9735

Number	Element	Mulliken
1	N	0.084
2	O	-0.247
3	H	0.164

All results from a given calculation for NOH (Hydroxyimidogen)

using model chemistry: M06-2X/aug-cc-pVDZ

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
	-1.667	-1.358	0.000	2.150
CHELPG
AIM
ESP

	x	y	z
x	1.860	0.206	0.000
y	0.206	2.701	0.000
z	0.000	0.000	1.662

<r²>	15.117
(<r²>)^1/2	3.888