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	hartrees
Energy at 0K	-185.035201
Energy at 298.15K
HF Energy	-184.630212
Nuclear repulsion energy	88.850872

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3255	3255	0.00
2	A_g	2294	2294	0.00
3	A_g	1210	1210	0.00
4	A_g	927	927	0.00
5	A_g	282	282	0.00
6	A_u	1008	1008	149.42
7	A_u	278	278	0.02
8	B_g	761	761	0.00
9	B_u	3258	3258	19.04
10	B_u	1734	1734	66.88
11	B_u	1208	1208	457.52
12	B_u	296	296	40.44

Atom	x (Å)	y (Å)
C1	0.005	-0.641
C2	-0.005	0.641
N3	-0.005	-1.897
N4	0.005	1.897
H5	0.930	-2.349
H6	-0.930	2.349

	C1	C2	N3	N4	H5	H6
C1		1.2821	1.2557	2.5377	1.9425	3.1329
C2	1.2821		2.5377	1.2557	3.1329	1.9425
N3	1.2557	2.5377		3.7933	1.0385	4.3454
N4	2.5377	1.2557	3.7933		4.3454	1.0385
H5	1.9425	3.1329	1.0385	4.3454		5.0530
H6	3.1329	1.9425	4.3454	1.0385	5.0530

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	179.121		C1	N3	H5	115.387
C2	C1	N3	179.121		C2	N4	H6	115.387

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: MP3=FULL/3-21G

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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