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	hartrees
Energy at 0K	-168.591306
Energy at 298.15K
HF Energy	-168.591306
Nuclear repulsion energy	60.928180

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	3504	3504	274.68	27.98	0.21	0.35
2	Σ	2357	2357	461.72	56.23	0.07	0.13
3	Σ	1321	1321	160.99	23.41	0.18	0.31
4	Π	579	579	1.87	0.29	0.75	0.86
4	Π	579	579	1.87	0.29	0.75	0.86
5	Π	314	314	72.91	4.59	0.75	0.86
5	Π	314	314	72.91	4.59	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	1.173
N2	0.000	0.000	-0.020
C3	0.000	0.000	-1.170
H4	0.000	0.000	-2.230

	O1	N2	C3	H4
O1		1.1927	2.3428	3.4028
N2	1.1927		1.1501	2.2102
C3	2.3428	1.1501		1.0600
H4	3.4028	2.2102	1.0600

Number	Element	Mulliken
1	O	-0.401
2	N	0.036
3	C	0.087
4	H	0.278

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

using model chemistry: wB97X-D/aug-cc-pVQZ

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>	34.059
(<r²>)^1/2	5.836