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	hartrees
Energy at 0K	-185.751507
Energy at 298.15K
HF Energy	-185.751507
Nuclear repulsion energy	90.967443

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	3662	3313	0.00	535.61	0.30	0.46
2	A_g	2430	2198	0.00	94.47	0.36	0.53
3	A_g	1268	1147	0.00	15.86	0.55	0.71
4	A_g	997	902	0.00	63.91	0.16	0.28
5	A_g	334	303	0.00	6.29	0.61	0.76
6	A_u	1046	946	146.63	0.00	0.00	0.00
7	A_u	277	251	0.61	0.00	0.00	0.00
8	B_g	702	635	0.00	5.38	0.75	0.86
9	B_u	3663	3314	57.87	0.00	0.00	0.00
10	B_u	1881	1702	355.85	0.00	0.00	0.00
11	B_u	1264	1144	344.23	0.00	0.00	0.00
12	B_u	316	286	11.56	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.119	-0.625
C2	-0.119	0.625
N3	0.119	-1.846
N4	-0.119	1.846
H5	1.045	-2.239
H6	-1.045	2.239

	C1	C2	N3	N4	H5	H6
C1		1.2721	1.2213	2.4824	1.8608	3.0914
C2	1.2721		2.4824	1.2213	3.0914	1.8608
N3	1.2213	2.4824		3.7000	1.0059	4.2477
N4	2.4824	1.2213	3.7000		4.2477	1.0059
H5	1.8608	3.0914	1.0059	4.2477		4.9417
H6	3.0914	1.8608	4.2477	1.0059	4.9417

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	169.192		C1	N3	H5	112.980
C2	C1	N3	169.192		C2	N4	H6	112.980

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: HF/daug-cc-pVTZ

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	0.536
2	C	0.536
3	N	-0.954
4	N	-0.954
5	H	0.419
6	H	0.419

	x	y	z
x	4.297	-1.316	0.000
y	-1.316	11.401	0.000
z	0.000	0.000	3.668

<r²>	79.333
(<r²>)^1/2	8.907