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	hartrees
Energy at 0K	-185.717465
Energy at 298.15K
HF Energy	-185.717465
Nuclear repulsion energy	90.868006

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	3336	0.00	615.11	0.32	0.49
2	A_g	2458	2223	0.00	88.41	0.33	0.49
3	A_g	1294	1171	0.00	14.19	0.74	0.85
4	A_g	999	904	0.00	49.14	0.28	0.44
5	A_g	304	275	0.00	5.97	0.64	0.78
6	A_u	1064	962	175.37	0.00	0.00	0.00
7	A_u	281	254	0.60	0.00	0.00	0.00
8	B_g	705	638	0.00	10.28	0.75	0.86
9	B_u	3691	3338	16.63	0.00	0.00	0.00
10	B_u	1889	1708	319.70	0.00	0.00	0.00
11	B_u	1291	1168	368.89	0.00	0.00	0.00
12	B_u	319	288	17.75	0.00	0.00	0.00

Atom	x (Å)	y (Å)
C1	0.106	-0.627
C2	-0.106	0.627
N3	0.106	-1.851
N4	-0.106	1.851
H5	1.035	-2.238
H6	-1.035	2.238

	C1	C2	N3	N4	H5	H6
C1		1.2716	1.2238	2.4865	1.8592	3.0833
C2	1.2716		2.4865	1.2238	3.0833	1.8592
N3	1.2238	2.4865		3.7073	1.0060	4.2444
N4	2.4865	1.2238	3.7073		4.2444	1.0060
H5	1.8592	3.0833	1.0060	4.2444		4.9306
H6	3.0833	1.8592	4.2444	1.0060	4.9306

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	170.384		C1	N3	H5	112.625
C2	C1	N3	170.384		C2	N4	H6	112.625

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: HF/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	0.302
2	C	0.302
3	N	-0.631
4	N	-0.631
5	H	0.329
6	H	0.329

	x	y	z
x	3.043	-1.443	0.000
y	-1.443	10.471	0.000
z	0.000	0.000	2.289

<r²>	79.382
(<r²>)^1/2	8.910