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	hartrees
Energy at 0K	-168.643152
Energy at 298.15K
HF Energy	-168.643152
Nuclear repulsion energy	60.542288

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	3493	3493	254.19	32.51	0.24	0.38
2	Σ	2312	2312	414.60	45.79	0.05	0.10
3	Σ	1291	1291	123.32	24.23	0.20	0.34
4	Π	566	566	4.04	0.17	0.75	0.86
4	Π	566	566	4.04	0.17	0.75	0.86
5	Π	77	77	74.25	5.67	0.75	0.86
5	Π	77	77	74.25	5.67	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	1.181
N2	0.000	0.000	-0.020
C3	0.000	0.000	-1.178
H4	0.000	0.000	-2.239

	O1	N2	C3	H4
O1		1.2001	2.3588	3.4195
N2	1.2001		1.1587	2.2194
C3	2.3588	1.1587		1.0607
H4	3.4195	2.2194	1.0607

Number	Element	Mulliken
1	O	-0.624
2	N	-0.115
3	C	0.491
4	H	0.247

All results from a given calculation for HCNO (fulminic acid)

using model chemistry: TPSSh/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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<r²>	34.411
(<r²>)^1/2	5.866