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	hartrees
Energy at 0K	-129.842510
Energy at 298.15K	-129.843615
HF Energy	-129.842510
Nuclear repulsion energy	29.047841

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4068	3666	106.45
2	A'	1362	1227	48.18
3	A'	1269	1143	165.42

Atom	x (Å)	y (Å)
N1	0.056	0.757
O2	0.056	-0.555
H3	-0.840	-0.860

	N1	O2	H3
N1		1.3127	1.8494
O2	1.3127		0.9469
H3	1.8494	0.9469

Number	Element	Mulliken
1	N	0.026
2	O	-0.258
3	H	0.232

All results from a given calculation for NOH (Hydroxyimidogen)

using model chemistry: ROHF/cc-pVTZ

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
	-1.687	-0.974	0.000	1.948
CHELPG
AIM
ESP

<r²>	14.804
(<r²>)^1/2	3.848