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	hartrees
Energy at 0K	-148.437815
Energy at 298.15K	-148.440216
HF Energy	-147.922664
Nuclear repulsion energy	59.239359

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3559	3457
2	A	1228	1192
3	A	965	937
4	A	760	738
5	A	516	501
6	B	3560	3457
7	B	2143	2081
8	B	959	931
9	B	520	505

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.025
N2	0.000	1.240	-0.086
N3	0.000	-1.240	-0.086
H4	0.642	1.746	0.527
H5	-0.642	-1.746	0.527

	C1	N2	N3	H4	H5
C1		1.2447	1.2447	1.9263	1.9263
N2	1.2447		2.4795	1.0215	3.1145
N3	1.2447	2.4795		3.1145	1.0215
H4	1.9263	1.0215	3.1145		3.7196
H5	1.9263	3.1145	1.0215	3.7196

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	116.081		C1	N3	H5	116.081
N2	C1	N3	169.744

All results from a given calculation for HNCNH (diiminomethane)

using model chemistry: CCSD(T)=FULL/aug-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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