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	hartrees
Energy at 0K	-187.685957
Energy at 298.15K	-187.689861
HF Energy	-186.943236
Nuclear repulsion energy	101.496448

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3639	3479
2	A	3546	3390
3	A	2361	2257
4	A	1665	1592
5	A	1219	1166
6	A	814	778
7	A	686	656
8	A	386	369
9	A	338	324
10	A	183	175
11	B	3639	3479
12	B	3548	3392
13	B	1664	1591
14	B	1336	1278
15	B	1218	1164
16	B	746	713
17	B	351	336
18	B	163	156

Atom	x (Å)	y (Å)	z (Å)
C1	0.068	0.602	-0.013
C2	-0.068	-0.602	-0.013
N3	0.068	1.970	-0.052
N4	-0.068	-1.970	-0.052
H5	-0.215	2.398	0.820
H6	0.941	2.360	-0.379
H7	0.215	-2.398	0.820
H8	-0.941	-2.360	-0.379

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2109	1.3688	2.5754	1.9996	1.9971	3.1162	3.1500
C2	1.2109		2.5754	1.3688	3.1162	3.1500	1.9996	1.9971
N3	1.3688	2.5754		3.9421	1.0110	1.0110	4.4562	4.4577
N4	2.5754	1.3688	3.9421		4.4562	4.4577	1.0110	1.0110
H5	1.9996	3.1162	1.0110	4.4562		1.6654	4.8147	4.9597
H6	1.9971	3.1500	1.0110	4.4577	1.6654		4.9597	5.0813
H7	3.1162	1.9996	4.4562	1.0110	4.8147	4.9597		1.6654
H8	3.1500	1.9971	4.4577	1.0110	4.9597	5.0813	1.6654

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	173.388	C1	N3	H5	113.476
C1	N3	H6	113.256	C2	C1	N3	173.388
C2	N4	H7	113.476	C2	N4	H8	113.256
H5	N3	H6	110.893	H7	N4	H8	110.893

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: CCSD(T)=FULL/TZVP

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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All results from a given calculation for NH2CCNH2 (Diaminoacetylene)

using model chemistry: CCSD(T)=FULL/TZVP

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)