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	hartrees
Energy at 0K	-186.776447
Energy at 298.15K
HF Energy	-186.776447
Nuclear repulsion energy	89.857205

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	3427	3427	0.00	685.05	0.31	0.47
2	A_g	2273	2273	0.00	28.40	0.41	0.58
3	A_g	1179	1179	0.00	20.41	0.75	0.85
4	A_g	951	951	0.00	38.27	0.28	0.44
5	A_g	268	268	0.00	4.31	0.49	0.66
6	A_u	973	973	141.70	0.00	0.00	0.00
7	A_u	255	255	0.02	0.00	0.00	0.00
8	B_g	666	666	0.00	6.68	0.75	0.86
9	B_u	3428	3428	20.43	0.00	0.00	0.00
10	B_u	1795	1795	195.35	0.00	0.00	0.00
11	B_u	1160	1160	337.65	0.00	0.00	0.00
12	B_u	288	288	10.70	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.181	-0.618
C2	-0.181	0.618
N3	0.181	-1.857
N4	-0.181	1.857
H5	1.133	-2.237
H6	-1.133	2.237

	C1	C2	N3	N4	H5	H6
C1		1.2881	1.2386	2.5011	1.8779	3.1428
C2	1.2881		2.5011	1.2386	3.1428	1.8779
N3	1.2386	2.5011		3.7310	1.0251	4.2993
N4	2.5011	1.2386	3.7310		4.2993	1.0251
H5	1.8779	3.1428	1.0251	4.2993		5.0148
H6	3.1428	1.8779	4.2993	1.0251	5.0148

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	163.678		C1	N3	H5	111.766
C2	C1	N3	163.678		C2	N4	H6	111.766

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	0.171
2	C	0.171
3	N	-0.397
4	N	-0.397
5	H	0.226
6	H	0.226

	x	y	z
x	3.492	-1.850	0.000
y	-1.850	10.272	0.000
z	0.000	0.000	2.342

<r²>	80.201
(<r²>)^1/2	8.956