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	hartrees
Energy at 0K	-148.402943
Energy at 298.15K	-148.405328
HF Energy	-147.909460
Nuclear repulsion energy	59.256123

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3563	3417
2	A	1234	1184
3	A	981	941
4	A	786	754
5	A	497	477
6	B	3565	3419
7	B	2175	2086
8	B	972	932
9	B	502	482

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.021
N2	0.000	1.240	-0.086
N3	0.000	-1.240	-0.086
H4	0.655	1.721	0.538
H5	-0.655	-1.721	0.538

	C1	N2	N3	H4	H5
C1		1.2448	1.2448	1.9123	1.9123
N2	1.2448		2.4802	1.0241	3.0961
N3	1.2448	2.4802		3.0961	1.0241
H4	1.9123	1.0241	3.0961		3.6828
H5	1.9123	3.0961	1.0241	3.6828

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	114.536		C1	N3	H5	114.536
N2	C1	N3	170.091

All results from a given calculation for HNCNH (diiminomethane)

using model chemistry: QCISD(T)=FULL/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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