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	hartrees
Energy at 0K	-186.457832
Energy at 298.15K
HF Energy	-185.752312
Nuclear repulsion energy	89.717968

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3497	3497	0.00
2	A_g	2181	2181	0.00
3	A_g	1202	1202	0.00
4	A_g	945	945	0.00
5	A_g	304	304	0.00
6	A_u	978	978	123.35
7	A_u	249	249	0.07
8	B_g	666	666	0.00
9	B_u	3497	3497	24.33
10	B_u	1771	1771	152.09
11	B_u	1175	1175	372.46
12	B_u	288	288	6.03

Atom	x (Å)	y (Å)
C1	0.241	-0.604
C2	-0.241	0.604
N3	0.241	-1.846
N4	-0.241	1.846
H5	1.188	-2.219
H6	-1.188	2.219

	C1	C2	N3	N4	H5	H6
C1		1.2998	1.2421	2.4962	1.8726	3.1638
C2	1.2998		2.4962	1.2421	3.1638	1.8726
N3	1.2421	2.4962		3.7226	1.0178	4.3087
N4	2.4962	1.2421	3.7226		4.3087	1.0178
H5	1.8726	3.1638	1.0178	4.3087		5.0343
H6	3.1638	1.8726	4.3087	1.0178	5.0343

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	158.218		C1	N3	H5	111.534
C2	C1	N3	158.218		C2	N4	H6	111.534

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: MP3/Def2TZVPP

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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