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	hartrees
Energy at 0K	-187.502695
Energy at 298.15K	-187.506540
HF Energy	-186.866947
Nuclear repulsion energy	100.970077

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3590	3590
2	A	3499	3499
3	A	2376	2376
4	A	1703	1703
5	A	1236	1236
6	A	821	821
7	A	697	697
8	A	363	363
9	A	325	325
10	A	185	185
11	B	3590	3590
12	B	3502	3502
13	B	1703	1703
14	B	1348	1348
15	B	1234	1234
16	B	759	759
17	B	332	332
18	B	170	170

Atom	x (Å)	y (Å)	z (Å)
C1	0.052	0.607	-0.013
C2	-0.052	-0.607	-0.013
N3	0.052	1.981	-0.055
N4	-0.052	-1.981	-0.055
H5	-0.214	2.407	0.831
H6	0.941	2.367	-0.369
H7	0.214	-2.407	0.831
H8	-0.941	-2.367	-0.369

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2182	1.3749	2.5905	2.0054	2.0033	3.1338	3.1549
C2	1.2182		2.5905	1.3749	3.1338	3.1549	2.0054	2.0033
N3	1.3749	2.5905		3.9637	1.0181	1.0182	4.4795	4.4706
N4	2.5905	1.3749	3.9637		4.4795	4.4706	1.0181	1.0182
H5	2.0054	3.1338	1.0181	4.4795		1.6650	4.8327	4.9753
H6	2.0033	3.1549	1.0182	4.4706	1.6650		4.9753	5.0934
H7	3.1338	2.0054	4.4795	1.0181	4.8327	4.9753		1.6650
H8	3.1549	2.0033	4.4706	1.0182	4.9753	5.0934	1.6650

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	174.814	C1	N3	H5	113.024
C1	N3	H6	112.826	C2	C1	N3	174.814
C2	N4	H7	113.024	C2	N4	H8	112.826
H5	N3	H6	109.704	H7	N4	H8	109.704

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: QCISD(T)=FULL/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: QCISD(T)=FULL/6-31G*

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)