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	hartrees
Energy at 0K	-167.779953
Energy at 298.15K	-167.781083
Nuclear repulsion energy	60.024142

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3865	3510	182.61
2	A'	2467	2240	1072.42
3	A'	1445	1312	0.06
4	A'	920	836	232.54
5	A'	598	543	123.57
6	A"	712	646	24.19

Atom	x (Å)	y (Å)
H1	0.876	-1.661
N2	0.010	-1.158
C3	0.000	0.048
O4	-0.118	1.185

	H1	N2	C3	O4
H1		1.0014	1.9203	3.0151
N2	1.0014		1.2058	2.3469
C3	1.9203	1.2058		1.1437
O4	3.0151	2.3469	1.1437

Number	Element	Mulliken	CHELPG
1	H	0.172	0.376
2	N	-0.351	-0.742
3	C	0.422	0.805
4	O	-0.243	-0.439

All results from a given calculation for HNCO (Isocyanic acid)

using model chemistry: HF/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
	1.736	-1.224	0.000	2.124
CHELPG
AIM
ESP

	x	y	z
x	1.558	-0.292	0.000
y	-0.292	3.988	0.000
z	0.000	0.000	1.324

<r²>	34.539
(<r²>)^1/2	5.877