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	hartrees
Energy at 0K	-186.293943
Energy at 298.15K
HF Energy	-185.664775
Nuclear repulsion energy	88.433665

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	3373	3236
2	A_g	1981	1900
3	A_g	1204	1155
4	A_g	910	873
5	A_g	370	355
6	A_u	934	896
7	A_u	239	229
8	B_g	716	686
9	B_u	3374	3236
10	B_u	1711	1641
11	B_u	1145	1098
12	B_u	284	273

Atom	x (Å)	y (Å)
C1	0.183	-0.645
C2	-0.183	0.645
N3	-0.183	-1.854
N4	0.183	1.854
H5	0.631	-2.489
H6	-0.631	2.489

	C1	C2	N3	N4	H5	H6
C1		1.3403	1.2634	2.4991	1.8975	3.2372
C2	1.3403		2.4991	1.2634	3.2372	1.8975
N3	1.2634	2.4991		3.7266	1.0315	4.3660
N4	2.4991	1.2634	3.7266		4.3660	1.0315
H5	1.8975	3.2372	1.0315	4.3660		5.1346
H6	3.2372	1.8975	4.3660	1.0315	5.1346

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	147.401		C1	N3	H5	111.147
C2	C1	N3	147.401		C2	N4	H6	111.147

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: QCISD(T)/6-31G*

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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