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	hartrees
Energy at 0K	-129.858916
Energy at 298.15K
HF Energy	-129.858916
Nuclear repulsion energy	30.563929

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	2701	2701	174.28	262.07	0.36	0.53
2	A'	1671	1671	98.90	17.94	0.75	0.86
3	A'	1504	1504	8.22	18.66	0.44	0.61

Atom	x (Å)	y (Å)
H1	-0.957	0.928
N2	0.064	0.574
O3	0.064	-0.618

	H1	N2	O3
H1		1.0805	1.8530
N2	1.0805		1.1925
O3	1.8530	1.1925

Number	Element	Mulliken
1	H	0.153
2	N	0.055
3	O	-0.208

All results from a given calculation for HNO (Nitrosyl hydride)

using model chemistry: SVWN/6-311+G(3df,2p)

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
	-1.371	0.813	0.000	1.595
CHELPG
AIM
ESP

	x	y	z
x	2.306	-0.422	0.000
y	-0.422	2.691	0.000
z	0.000	0.000	1.481

<r²>	14.327
(<r²>)^1/2	3.785