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	hartrees
Energy at 0K	-187.788591
Energy at 298.15K	-187.792697
HF Energy	-186.950873
Nuclear repulsion energy	101.920726

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3650	3493
2	A	3564	3410
3	A	2384	2281
4	A	1672	1600
5	A	1220	1167
6	A	819	784
7	A	634	607
8	A	422	404
9	A	355	340
10	A	213	204
11	B	3650	3493
12	B	3566	3412
13	B	1669	1597
14	B	1359	1300
15	B	1220	1167
16	B	688	658
17	B	421	403
18	B	214	205

Atom	x (Å)	y (Å)	z (Å)
C1	0.013	0.604	-0.001
C2	-0.013	-0.604	-0.001
N3	-0.013	1.963	-0.058
N4	0.013	-1.963	-0.058
H5	-0.316	2.401	0.796
H6	0.848	2.372	-0.384
H7	0.316	-2.401	0.796
H8	-0.848	-2.372	-0.384

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2075	1.3607	2.5670	1.9936	1.9921	3.1232	3.1209
C2	1.2075		2.5670	1.3607	3.1232	3.1209	1.9936	1.9921
N3	1.3607	2.5670		3.9256	1.0071	1.0073	4.4589	4.4259
N4	2.5670	1.3607	3.9256		4.4589	4.4259	1.0071	1.0073
H5	1.9936	3.1232	1.0071	4.4589		1.6579	4.8434	4.9449
H6	1.9921	3.1209	1.0073	4.4259	1.6579		4.9449	5.0372
H7	3.1232	1.9936	4.4589	1.0071	4.8434	4.9449		1.6579
H8	3.1209	1.9921	4.4259	1.0073	4.9449	5.0372	1.6579

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	176.581	C1	N3	H5	113.866
C1	N3	H6	113.717	C2	C1	N3	176.581
C2	N4	H7	113.866	C2	N4	H8	113.717
H5	N3	H6	110.774	H7	N4	H8	110.774

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: QCISD(T)=FULL/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)