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	hartrees
Energy at 0K	-148.381968
Energy at 298.15K	-148.384338
HF Energy	-147.891296
Nuclear repulsion energy	59.487819

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3561	3561
2	A	1254	1254
3	A	961	961
4	A	783	783
5	A	504	504
6	B	3563	3563
7	B	2208	2208
8	B	956	956
9	B	505	505

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.026
N2	0.000	1.233	-0.084
N3	0.000	-1.233	-0.084
H4	0.638	1.759	0.511
H5	-0.638	-1.759	0.511

	C1	N2	N3	H4	H5
C1		1.2381	1.2381	1.9332	1.9332
N2	1.2381		2.4665	1.0190	3.1170
N3	1.2381	2.4665		3.1170	1.0190
H4	1.9332	1.0190	3.1170		3.7425
H5	1.9332	3.1170	1.0190	3.7425

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	117.519		C1	N3	H5	117.519
N2	C1	N3	169.785

All results from a given calculation for HNCNH (diiminomethane)

using model chemistry: QCISD(T)=FULL/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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