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	hartrees
Energy at 0K	-186.769948
Energy at 298.15K
HF Energy	-186.769948
Nuclear repulsion energy	89.842426

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A_g	3426	3426	0.00	688.21	0.32	0.48
2	A_g	2263	2263	0.00	28.18	0.43	0.60
3	A_g	1197	1197	0.00	22.68	0.75	0.85
4	A_g	951	951	0.00	38.32	0.28	0.44
5	A_g	286	286	0.00	4.62	0.45	0.62
6	A_u	981	981	152.11	0.00	0.00	0.00
7	A_u	257	257	0.02	0.00	0.00	0.00
8	B_g	673	673	0.00	7.32	0.75	0.86
9	B_u	3427	3427	7.50	0.00	0.00	0.00
10	B_u	1794	1794	193.09	0.00	0.00	0.00
11	B_u	1173	1173	368.32	0.00	0.00	0.00
12	B_u	289	289	10.93	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.192	-0.615
C2	-0.192	0.615
N3	0.192	-1.854
N4	-0.192	1.854
H5	1.141	-2.241
H6	-1.141	2.241

	C1	C2	N3	N4	H5	H6
C1		1.2897	1.2386	2.4993	1.8826	3.1529
C2	1.2897		2.4993	1.2386	3.1529	1.8826
N3	1.2386	2.4993		3.7280	1.0248	4.3072
N4	2.4993	1.2386	3.7280		4.3072	1.0248
H5	1.8826	3.1529	1.0248	4.3072		5.0305
H6	3.1529	1.8826	4.3072	1.0248	5.0305

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	162.637		C1	N3	H5	112.215
C2	C1	N3	162.637		C2	N4	H6	112.215

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: M06-2X/6-311G*

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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Number	Element	Mulliken
1	C	0.214
2	C	0.214
3	N	-0.537
4	N	-0.537
5	H	0.323
6	H	0.323

	x	y	z
x	3.494	-1.909	0.000
y	-1.909	10.238	0.000
z	0.000	0.000	2.280

<r²>	80.223
(<r²>)^1/2	8.957