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	hartrees
Energy at 0K	-25.869439
Energy at 298.15K	-25.870544
HF Energy	-25.869439
Nuclear repulsion energy	16.665727

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4068	3654	90.40
2	A'	1351	1214	69.64
3	A'	1296	1164	152.66

Atom	x (Å)	y (Å)
N1	0.057	0.767
O2	0.057	-0.564
H3	-0.852	-0.862

	N1	O2	H3
N1		1.3308	1.8660
O2	1.3308		0.9567
H3	1.8660	0.9567

Number	Element	Mulliken
1	N	0.013
2	O	-0.447
3	H	0.434

All results from a given calculation for NOH (Hydroxyimidogen)

using model chemistry: HF/CEP-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
	-1.891	-0.914	0.000	2.101
CHELPG
AIM
ESP

	x	y	z
x	1.311	0.214	0.000
y	0.214	2.047	0.000
z	0.000	0.000	0.868

<r²>	13.242
(<r²>)^1/2	3.639