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	hartrees
Energy at 0K	-186.336946
Energy at 298.15K
HF Energy	-185.703881
Nuclear repulsion energy	88.534214

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3426	3426	0.00
2	A_g	2102	2102	0.00
3	A_g	1192	1192	0.00
4	A_g	917	917	0.00
5	A_g	300	300	0.00
6	A_u	949	949	113.71
7	A_u	242	242	0.03
8	B_g	676	676	0.00
9	B_u	3426	3426	15.07
10	B_u	1722	1722	152.99
11	B_u	1164	1164	372.16
12	B_u	277	277	4.97

Atom	x (Å)	y (Å)
C1	0.285	-0.598
C2	-0.285	0.598
N3	0.285	-1.858
N4	-0.285	1.858
H5	1.246	-2.226
H6	-1.246	2.226

	C1	C2	N3	N4	H5	H6
C1		1.3253	1.2594	2.5213	1.8902	3.2124
C2	1.3253		2.5213	1.2594	3.2124	1.8902
N3	1.2594	2.5213		3.7589	1.0292	4.3612
N4	2.5213	1.2594	3.7589		4.3612	1.0292
H5	1.8902	3.2124	1.0292	4.3612		5.1019
H6	3.2124	1.8902	4.3612	1.0292	5.1019

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	C2	N4	154.552		C1	N3	H5	110.964
C2	C1	N3	154.552		C2	N4	H6	110.964

All results from a given calculation for HNCCNH (Ethenediimine)

using model chemistry: CCSD=FULL/daug-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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