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	hartrees
Energy at 0K	-130.396307
Energy at 298.15K	-130.397398
HF Energy	-130.396307
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3764	3764	68.26
2	A'	1290	1290	17.48
3	A'	1168	1168	175.95

Atom	x (Å)	y (Å)
N1	0.057	0.761
O2	0.057	-0.557
H3	-0.862	-0.870

	N1	O2	H3
N1		1.3188	1.8725
O2	1.3188		0.9710
H3	1.8725	0.9710

Number	Element	Mulliken
1	N	-0.007
2	O	-0.358
3	H	0.366

All results from a given calculation for NOH (Hydroxyimidogen)

using model chemistry: wB97X-D/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
	-1.785	-1.428	0.000	2.286
CHELPG
AIM
ESP

	x	y	z
x	1.280	0.249	0.000
y	0.249	2.137	0.000
z	0.000	0.000	0.886

<r²>	14.857
(<r²>)^1/2	3.854