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	hartrees
Energy at 0K	-186.843633
Energy at 298.15K
HF Energy	-186.843633
Nuclear repulsion energy	89.049128

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	3266	3248	0.00	820.43	0.33	0.50
2	A_g	2021	2010	0.00	24.98	0.40	0.57
3	A_g	1146	1139	0.00	37.86	0.52	0.69
4	A_g	906	901	0.00	48.07	0.15	0.27
5	A_g	337	336	0.00	2.18	0.50	0.67
6	A_u	927	922	109.25	0.00	0.00	0.00
7	A_u	245	244	0.06	0.00	0.00	0.00
8	B_g	679	675	0.00	4.19	0.75	0.86
9	B_u	3265	3247	1.35	0.00	0.00	0.00
10	B_u	1687	1678	145.15	0.00	0.00	0.00
11	B_u	1100	1094	383.57	0.00	0.00	0.00
12	B_u	272	271	6.35	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.283	-0.591
C2	-0.283	0.591
N3	0.283	-1.843
N4	-0.283	1.843
H5	1.231	-2.252
H6	-1.231	2.252

	C1	C2	N3	N4	H5	H6
C1		1.3101	1.2522	2.4987	1.9127	3.2207
C2	1.3101		2.4987	1.2522	3.2207	1.9127
N3	1.2522	2.4987		3.7292	1.0327	4.3658
N4	2.4987	1.2522	3.7292		4.3658	1.0327
H5	1.9127	3.2207	1.0327	4.3658		5.1328
H6	3.2207	1.9127	4.3658	1.0327	5.1328

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	154.425		C1	N3	H5	113.322
C2	C1	N3	154.425		C2	N4	H6	113.322

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: BLYP/6-311+G(3df,2p)

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	0.491
2	C	0.491
3	N	-0.717
4	N	-0.717
5	H	0.227
6	H	0.227

	x	y	z
x	5.204	-2.219	0.000
y	-2.219	11.843	0.000
z	0.000	0.000	3.795

<r²>	81.155
(<r²>)^1/2	9.009