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	hartrees
Energy at 0K	-167.665734
Energy at 298.15K	-167.666748
Nuclear repulsion energy	58.099356

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4032	3628	209.90
2	A'	2557	2301	150.80
3	A'	1306	1175	151.53
4	A'	1125	1013	95.03
5	A'	514	462	22.83
6	A"	564	507	10.07

Atom	x (Å)	y (Å)
N1	0.060	1.339
C2	0.000	0.190
O3	-0.136	-1.111
H4	0.669	-1.625

	N1	C2	O3	H4
N1		1.1508	2.4572	3.0259
C2	1.1508		1.3072	1.9341
O3	2.4572	1.3072		0.9555
H4	3.0259	1.9341	0.9555

Number	Element	Mulliken
1	N	-0.147
2	C	0.221
3	O	-0.535
4	H	0.462

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

using model chemistry: HF/LANL2DZ

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
	1.925	-3.587	0.000	4.071
CHELPG
AIM
ESP

	x	y	z
x	1.499	-0.091	0.000
y	-0.091	4.007	0.000
z	0.000	0.000	1.231

<r²>	0.000
(<r²>)^1/2	0.000