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	hartrees
Energy at 0K	-187.524908
Energy at 298.15K	-187.528756
HF Energy	-186.882660
Nuclear repulsion energy	101.050797

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3679	3489
2	A	3581	3397
3	A	2372	2250
4	A	1692	1605
5	A	1232	1169
6	A	821	778
7	A	691	656
8	A	379	360
9	A	325	308
10	A	192	182
11	B	3678	3489
12	B	3583	3399
13	B	1691	1604
14	B	1347	1277
15	B	1230	1167
16	B	751	712
17	B	322	306
18	B	159	151

Atom	x (Å)	y (Å)	z (Å)
C1	0.070	0.606	-0.018
C2	-0.070	-0.606	-0.018
N3	0.070	1.981	-0.052
N4	-0.070	-1.981	-0.052
H5	-0.192	2.395	0.834
H6	0.954	2.364	-0.361
H7	0.192	-2.395	0.834
H8	-0.954	-2.364	-0.361

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2193	1.3758	2.5907	1.9993	1.9977	3.1219	3.1597
C2	1.2193		2.5907	1.3758	3.1219	3.1597	1.9993	1.9977
N3	1.3758	2.5907		3.9647	1.0119	1.0120	4.4667	4.4747
N4	2.5907	1.3758	3.9647		4.4667	4.4747	1.0119	1.0120
H5	1.9993	3.1219	1.0119	4.4667		1.6558	4.8057	4.9658
H6	1.9977	3.1597	1.0120	4.4747	1.6558		4.9658	5.0982
H7	3.1219	1.9993	4.4667	1.0119	4.8057	4.9658		1.6558
H8	3.1597	1.9977	4.4747	1.0120	4.9658	5.0982	1.6558

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	173.295	C1	N3	H5	112.823
C1	N3	H6	112.681	C2	C1	N3	173.295
C2	N4	H7	112.823	C2	N4	H8	112.681
H5	N3	H6	109.793	H7	N4	H8	109.793

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: CCSD(T)/6-31G**

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)/6-31G**

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)