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	hartrees
Energy at 0K	-148.370382
Energy at 298.15K	-148.372743
HF Energy	-147.890908
Nuclear repulsion energy	59.423870

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3558	3413
2	A	1250	1199
3	A	964	924
4	A	783	751
5	A	501	480
6	B	3560	3415
7	B	2200	2110
8	B	957	918
9	B	497	477

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.029
N2	0.000	1.235	-0.085
N3	0.000	-1.235	-0.085
H4	0.638	1.760	0.511
H5	-0.638	-1.760	0.511

	C1	N2	N3	H4	H5
C1		1.2398	1.2398	1.9333	1.9333
N2	1.2398		2.4690	1.0193	3.1195
N3	1.2398	2.4690		3.1195	1.0193
H4	1.9333	1.0193	3.1195		3.7446
H5	1.9333	3.1195	1.0193	3.7446

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	117.360		C1	N3	H5	117.360
N2	C1	N3	169.394

All results from a given calculation for HNCNH (diiminomethane)

using model chemistry: QCISD(T)/6-31G*

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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