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	hartrees
Energy at 0K	-185.605585
Energy at 298.15K
HF Energy	-185.605585
Nuclear repulsion energy	89.718215

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	3689	3322	0.00	615.26	0.33	0.50
2	A_g	2444	2201	0.00	135.77	0.29	0.45
3	A_g	1230	1107	0.00	27.06	0.57	0.72
4	A_g	985	887	0.00	61.27	0.27	0.43
5	A_g	360	324	0.00	10.21	0.50	0.67
6	A_u	1068	962	210.29	0.00	0.00	0.00
7	A_u	280	252	0.00	0.00	0.00	0.00
8	B_g	711	640	0.00	18.32	0.75	0.86
9	B_u	3691	3323	50.75	0.00	0.00	0.00
10	B_u	1859	1674	262.53	0.00	0.00	0.00
11	B_u	1184	1066	618.82	0.00	0.00	0.00
12	B_u	309	279	22.79	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.128	-0.627
C2	-0.128	0.627
N3	0.128	-1.869
N4	-0.128	1.869
H5	1.024	-2.337
H6	-1.024	2.337

	C1	C2	N3	N4	H5	H6
C1		1.2789	1.2428	2.5090	1.9307	3.1792
C2	1.2789		2.5090	1.2428	3.1792	1.9307
N3	1.2428	2.5090		3.7475	1.0105	4.3610
N4	2.5090	1.2428	3.7475		4.3610	1.0105
H5	1.9307	3.1792	1.0105	4.3610		5.1024
H6	3.1792	1.9307	4.3610	1.0105	5.1024

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	168.485		C1	N3	H5	117.555
C2	C1	N3	168.485		C2	N4	H6	117.555

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: HF/SDD

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	0.052
2	C	0.052
3	N	-0.362
4	N	-0.362
5	H	0.311
6	H	0.311

	x	y	z
x	2.880	-1.663	0.000
y	-1.663	11.521	0.000
z	0.000	0.000	2.070

<r²>	81.641
(<r²>)^1/2	9.036