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	hartrees
Energy at 0K	-148.543835
Energy at 298.15K	-148.546243
HF Energy	-147.956086
Nuclear repulsion energy	59.903452

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3595	3504
2	A	1248	1216
3	A	954	930
4	A	761	741
5	A	526	512
6	B	3595	3504
7	B	2188	2133
8	B	945	921
9	B	527	513

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.019
N2	0.000	1.226	-0.083
N3	0.000	-1.226	-0.083
H4	0.636	1.732	0.521
H5	-0.636	-1.732	0.521

	C1	N2	N3	H4	H5
C1		1.2300	1.2300	1.9117	1.9117
N2	1.2300		2.4516	1.0119	3.0845
N3	1.2300	2.4516		3.0845	1.0119
H4	1.9117	1.0119	3.0845		3.6891
H5	1.9117	3.0845	1.0119	3.6891

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	116.677		C1	N3	H5	116.677
N2	C1	N3	170.550

All results from a given calculation for HNCNH (diiminomethane)

using model chemistry: CCSD(T)/cc-pVTZ

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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