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	hartrees
Energy at 0K	-186.431576
Energy at 298.15K
HF Energy	-185.734962
Nuclear repulsion energy	89.542836

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3451	3270	0.00
2	A_g	2135	2023	0.00
3	A_g	1197	1134	0.00
4	A_g	934	885	0.00
5	A_g	359	340	0.00
6	A_u	968	917	125.97
7	A_u	241	229	0.00
8	B_g	678	643	0.00
9	B_u	3452	3271	8.09
10	B_u	1746	1654	146.08
11	B_u	1166	1105	376.42
12	B_u	286	271	7.35

Atom	x (Å)	y (Å)
C1	0.274	-0.592
C2	-0.274	0.592
N3	0.274	-1.838
N4	-0.274	1.838
H5	1.228	-2.206
H6	-1.228	2.206

	C1	C2	N3	N4	H5	H6
C1		1.3049	1.2462	2.4912	1.8749	3.1760
C2	1.3049		2.4912	1.2462	3.1760	1.8749
N3	1.2462	2.4912		3.7170	1.0223	4.3143
N4	2.4912	1.2462	3.7170		4.3143	1.0223
H5	1.8749	3.1760	1.0223	4.3143		5.0499
H6	3.1760	1.8749	4.3143	1.0223	5.0499

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	155.129		C1	N3	H5	111.097
C2	C1	N3	155.129		C2	N4	H6	111.097

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: CCSD=FULL/TZVP

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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