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	hartrees
Energy at 0K	-186.324061
Energy at 298.15K
HF Energy	-185.702176
Nuclear repulsion energy	88.432990

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3426	3300	0.00
2	A_g	2073	1997	0.00
3	A_g	1186	1143	0.00
4	A_g	914	881	0.00
5	A_g	327	316	0.00
6	A_u	943	909	115.19
7	A_u	239	230	0.01
8	B_g	682	657	0.00
9	B_u	3426	3301	16.19
10	B_u	1719	1657	155.56
11	B_u	1154	1111	387.42
12	B_u	277	267	5.38

Atom	x (Å)	y (Å)
C1	0.305	-0.592
C2	-0.305	0.592
N3	0.305	-1.852
N4	-0.305	1.852
H5	1.267	-2.221
H6	-1.267	2.221

	C1	C2	N3	N4	H5	H6
C1		1.3324	1.2604	2.5197	1.8916	3.2227
C2	1.3324		2.5197	1.2604	3.2227	1.8916
N3	1.2604	2.5197		3.7549	1.0301	4.3663
N4	2.5197	1.2604	3.7549		4.3663	1.0301
H5	1.8916	3.2227	1.0301	4.3663		5.1139
H6	3.2227	1.8916	4.3663	1.0301	5.1139

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	152.725		C1	N3	H5	110.950
C2	C1	N3	152.725		C2	N4	H6	110.950

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: CCSD/aug-cc-pVDZ

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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