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	hartrees
Energy at 0K	-186.303752
Energy at 298.15K
HF Energy	-185.686264
Nuclear repulsion energy	89.221058

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3543	3301	0.00
2	A_g	2131	1985	0.00
3	A_g	1211	1128	0.00
4	A_g	948	883	0.00
5	A_g	346	322	0.00
6	A_u	977	910	138.12
7	A_u	248	231	0.00
8	B_g	709	660	0.00
9	B_u	3544	3302	19.31
10	B_u	1783	1661	162.74
11	B_u	1169	1089	386.51
12	B_u	284	265	7.22

Atom	x (Å)	y (Å)
C1	0.302	-0.586
C2	-0.302	0.586
N3	0.302	-1.836
N4	-0.302	1.836
H5	1.250	-2.210
H6	-1.250	2.210

	C1	C2	N3	N4	H5	H6
C1		1.3179	1.2504	2.4960	1.8812	3.1980
C2	1.3179		2.4960	1.2504	3.1980	1.8812
N3	1.2504	2.4960		3.7216	1.0195	4.3340
N4	2.4960	1.2504	3.7216		4.3340	1.0195
H5	1.8812	3.1980	1.0195	4.3340		5.0789
H6	3.1980	1.8812	4.3340	1.0195	5.0789

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	152.736		C1	N3	H5	111.532
C2	C1	N3	152.736		C2	N4	H6	111.532

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: MP3=FULL/6-31+G**

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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