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	hartrees
Energy at 0K	-186.290294
Energy at 298.15K
HF Energy	-185.690997
Nuclear repulsion energy	88.764614

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3463	3256	0.00
2	A_g	2136	2008	0.00
3	A_g	1207	1135	0.00
4	A_g	939	883	0.00
5	A_g	306	288	0.00
6	A_u	966	909	119.00
7	A_u	244	229	0.00
8	B_g	685	645	0.00
9	B_u	3464	3257	7.65
10	B_u	1768	1663	126.55
11	B_u	1175	1105	374.39
12	B_u	289	271	5.59

Atom	x (Å)	y (Å)
C1	0.292	-0.594
C2	-0.292	0.594
N3	0.292	-1.850
N4	-0.292	1.850
H5	1.261	-2.200
H6	-1.261	2.200

	C1	C2	N3	N4	H5	H6
C1		1.3247	1.2556	2.5133	1.8757	3.1975
C2	1.3247		2.5133	1.2556	3.1975	1.8757
N3	1.2556	2.5133		3.7459	1.0306	4.3380
N4	2.5133	1.2556	3.7459		4.3380	1.0306
H5	1.8757	3.1975	1.0306	4.3380		5.0724
H6	3.1975	1.8757	4.3380	1.0306	5.0724

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	153.830		C1	N3	H5	109.873
C2	C1	N3	153.830		C2	N4	H6	109.873

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: MP3=FULL/cc-pVDZ

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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