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	hartrees
Energy at 0K	-167.754252
Energy at 298.15K	-167.755307
Nuclear repulsion energy	58.955462

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4094	3728	213.85
2	A'	2612	2378	187.77
3	A'	1374	1251	122.65
4	A'	1185	1079	52.80
5	A'	521	474	18.74
6	A"	587	535	13.18

Atom	x (Å)	y (Å)
N1	0.134	1.312
C2	0.000	0.183
O3	-0.196	-1.090
H4	0.629	-1.559

	N1	C2	O3	H4
N1		1.1367	2.4238	2.9132
C2	1.1367		1.2874	1.8520
O3	2.4238	1.2874		0.9487
H4	2.9132	1.8520	0.9487

Number	Element	Mulliken
1	N	-0.239
2	C	0.361
3	O	-0.331
4	H	0.209

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

using model chemistry: HF/aug-cc-pVDZ

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
	1.202	-3.854	0.000	4.037
CHELPG
AIM
ESP

	x	y	z
x	2.421	0.065	0.000
y	0.065	4.228	0.000
z	0.000	0.000	2.281

<r²>	0.000
(<r²>)^1/2	0.000