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	hartrees
Energy at 0K	-147.397544
Energy at 298.15K	-147.399846
HF Energy	-147.049229
Nuclear repulsion energy	59.083208

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3515	3440
2	A	1201	1175
3	A	882	863
4	A	701	687
5	A	502	491
6	B	3519	3444
7	B	2183	2137
8	B	861	843
9	B	506	495

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.045
N2	0.000	1.237	-0.083
N3	0.000	-1.237	-0.083
H4	0.589	1.884	0.442
H5	-0.589	-1.884	0.442

	C1	N2	N3	H4	H5
C1		1.2434	1.2434	2.0133	2.0133
N2	1.2434		2.4736	1.0203	3.2189
N3	1.2434	2.4736		3.2189	1.0203
H4	2.0133	1.0203	3.2189		3.9476
H5	2.0133	3.2189	1.0203	3.9476

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	125.305		C1	N3	H5	125.305
N2	C1	N3	168.179

All results from a given calculation for HNCNH (diiminomethane)

using model chemistry: MP4=FULL/3-21G

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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