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	hartrees
Energy at 0K	-186.454200
Energy at 298.15K
HF Energy	-185.752452
Nuclear repulsion energy	89.661381

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3470	3470	0.00
2	A_g	2200	2200	0.00
3	A_g	1198	1198	0.00
4	A_g	940	940	0.00
5	A_g	294	294	0.00
6	A_u	974	974	123.17
7	A_u	248	248	0.12
8	B_g	658	658	0.00
9	B_u	3471	3471	19.71
10	B_u	1762	1762	142.96
11	B_u	1177	1177	357.76
12	B_u	287	287	6.36

Atom	x (Å)	y (Å)
C1	0.225	-0.608
C2	-0.225	0.608
N3	0.225	-1.851
N4	-0.225	1.851
H5	1.174	-2.226
H6	-1.174	2.226

	C1	C2	N3	N4	H5	H6
C1		1.2972	1.2431	2.5004	1.8750	3.1605
C2	1.2972		2.5004	1.2431	3.1605	1.8750
N3	1.2431	2.5004		3.7298	1.0195	4.3104
N4	2.5004	1.2431	3.7298		4.3104	1.0195
H5	1.8750	3.1605	1.0195	4.3104		5.0325
H6	3.1605	1.8750	4.3104	1.0195	5.0325

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	159.664		C1	N3	H5	111.554
C2	C1	N3	159.664		C2	N4	H6	111.554

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: CCD/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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