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	hartrees
Energy at 0K	-168.200142
Energy at 298.15K	-168.201000
Nuclear repulsion energy	57.580167

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3876	3648	129.45
2	A'	2372	2233	77.53
3	A'	1281	1206	110.82
4	A'	1088	1024	58.73
5	A'	416	392	15.41
6	A"	468	441	6.19

Atom	x (Å)	y (Å)
N1	0.121	1.346
C2	0.000	0.182
O3	-0.190	-1.119
H4	0.668	-1.564

	N1	C2	O3	H4
N1		1.1703	2.4840	2.9604
C2	1.1703		1.3142	1.8689
O3	2.4840	1.3142		0.9663
H4	2.9604	1.8689	0.9663

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

using model chemistry: QCISD/6-31G**

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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