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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	C*V	¹Σ
1	2	no	CS	¹A^'

	hartrees
Energy at 0K	-168.549885
Energy at 298.15K
HF Energy	-168.549885
Nuclear repulsion energy	60.694293

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3513	3382	233.91
2	Σ	2360	2272	372.16
3	Σ	1329	1280	118.78
4	X_pi	580	558	0.43
4	X_pi	580	558	0.43
5	X_pi	160	154	97.50
5	X_pi	160	154	97.50

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

using model chemistry: B3PW91/6-311G*

States and conformations

Conformer 1 (C*V)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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