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	hartrees
Energy at 0K	-186.720195
Energy at 298.15K
HF Energy	-186.720195
Nuclear repulsion energy	89.513755

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	3412	3232	0.00	733.88	0.32	0.48
2	A_g	2261	2141	0.00	27.05	0.41	0.58
3	A_g	1197	1134	0.00	24.62	0.75	0.86
4	A_g	960	910	0.00	38.60	0.31	0.47
5	A_g	316	300	0.00	3.85	0.39	0.56
6	A_u	975	923	148.66	0.00	0.00	0.00
7	A_u	255	241	0.12	0.00	0.00	0.00
8	B_g	677	642	0.00	11.23	0.75	0.86
9	B_u	3413	3232	5.27	0.00	0.00	0.00
10	B_u	1814	1717	187.75	0.00	0.00	0.00
11	B_u	1166	1104	366.99	0.00	0.00	0.00
12	B_u	287	272	8.90	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.220	-0.611
C2	-0.220	0.611
N3	0.220	-1.854
N4	-0.220	1.854
H5	1.174	-2.235
H6	-1.174	2.235

	C1	C2	N3	N4	H5	H6
C1		1.2979	1.2438	2.5039	1.8844	3.1691
C2	1.2979		2.5039	1.2438	3.1691	1.8844
N3	1.2438	2.5039		3.7347	1.0276	4.3209
N4	2.5039	1.2438	3.7347		4.3209	1.0276
H5	1.8844	3.1691	1.0276	4.3209		5.0502
H6	3.1691	1.8844	4.3209	1.0276	5.0502

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	160.190		C1	N3	H5	111.766
C2	C1	N3	160.190		C2	N4	H6	111.766

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: M06-2X/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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Number	Element	Mulliken
1	C	0.249
2	C	0.249
3	N	-0.596
4	N	-0.596
5	H	0.346
6	H	0.346

	x	y	z
x	3.421	-2.111	0.000
y	-2.111	10.032	0.000
z	0.000	0.000	1.975

<r²>	80.334
(<r²>)^1/2	8.963