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	hartrees
Energy at 0K	-31.402729
Energy at 298.15K	-31.403752
Nuclear repulsion energy	30.806184

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4097	3679	203.79
2	A'	2626	2358	212.74
3	A'	1369	1229	146.88
4	A'	1185	1064	52.61
5	A'	506	454	19.57
6	A"	573	515	12.09

Atom	x (Å)	y (Å)
N1	0.145	1.325
C2	0.000	0.183
O3	-0.206	-1.101
H4	0.629	-1.565

	N1	C2	O3	H4
N1		1.1516	2.4509	2.9303
C2	1.1516		1.2996	1.8574
O3	2.4509	1.2996		0.9553
H4	2.9303	1.8574	0.9553

Number	Element	Mulliken
1	N	0.232
2	C	-0.344
3	O	-0.377
4	H	0.489

All results from a given calculation for HOCN (cyanic acid)

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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	x	y	z	Total
	1.389	-3.808	0.000	4.054
CHELPG
AIM
ESP

	x	y	z
x	1.817	0.076	0.000
y	0.076	3.868	0.000
z	0.000	0.000	1.575

<r²>	0.000
(<r²>)^1/2	0.000