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	hartrees
Energy at 0K	-186.497239
Energy at 298.15K
HF Energy	-185.740700
Nuclear repulsion energy	89.005022

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3414	3239
2	A_g	2041	1936
3	A_g	1178	1118
4	A_g	905	858
5	A_g	303	287
6	A_u	941	892
7	A_u	244	231
8	B_g	679	644
9	B_u	3415	3239
10	B_u	1694	1607
11	B_u	1141	1082
12	B_u	281	266

Atom	x (Å)	y (Å)
C1	0.295	-0.588
C2	-0.295	0.588
N3	0.295	-1.843
N4	-0.295	1.843
H5	1.251	-2.210
H6	-1.251	2.210

	C1	C2	N3	N4	H5	H6
C1		1.3167	1.2549	2.5025	1.8823	3.1973
C2	1.3167		2.5025	1.2549	3.1973	1.8823
N3	1.2549	2.5025		3.7337	1.0235	4.3384
N4	2.5025	1.2549	3.7337		4.3384	1.0235
H5	1.8823	3.1973	1.0235	4.3384		5.0791
H6	3.1973	1.8823	4.3384	1.0235	5.0791

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	153.347		C1	N3	H5	111.004
C2	C1	N3	153.347		C2	N4	H6	111.004

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: QCISD(T)/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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