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	hartrees
Energy at 0K	-186.458142
Energy at 298.15K
HF Energy	-185.744172
Nuclear repulsion energy	89.461974

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3452	3299	0.00
2	A_g	2171	2074	0.00
3	A_g	1196	1142	0.00
4	A_g	927	885	0.00
5	A_g	279	267	0.00
6	A_u	966	923	120.72
7	A_u	249	238	0.07
8	B_g	664	635	0.00
9	B_u	3453	3299	13.23
10	B_u	1738	1661	145.23
11	B_u	1173	1121	389.48
12	B_u	286	274	5.42

Atom	x (Å)	y (Å)
C1	0.237	-0.606
C2	-0.237	0.606
N3	0.237	-1.853
N4	-0.237	1.853
H5	1.188	-2.223
H6	-1.188	2.223

	C1	C2	N3	N4	H5	H6
C1		1.3005	1.2470	2.5033	1.8764	3.1673
C2	1.3005		2.5033	1.2470	3.1673	1.8764
N3	1.2470	2.5033		3.7353	1.0205	4.3176
N4	2.5033	1.2470	3.7353		4.3176	1.0205
H5	1.8764	3.1673	1.0205	4.3176		5.0412
H6	3.1673	1.8764	4.3176	1.0205	5.0412

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	158.621		C1	N3	H5	111.294
C2	C1	N3	158.621		C2	N4	H6	111.294

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: QCISD/cc-pVTZ

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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