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	hartrees
Energy at 0K	-187.455932
Energy at 298.15K	-187.459900
HF Energy	-186.868694
Nuclear repulsion energy	101.374269

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3665	3440	16.04
2	A	3575	3356	3.49
3	A	2464	2312	0.00
4	A	1720	1615	17.10
5	A	1250	1174	0.01
6	A	838	787	14.73
7	A	699	656	118.03
8	A	393	369	0.00
9	A	333	312	43.36
10	A	207	194	12.01
11	B	3665	3440	14.64
12	B	3577	3357	11.55
13	B	1720	1614	37.64
14	B	1368	1284	71.97
15	B	1249	1172	0.36
16	B	754	708	415.88
17	B	346	325	18.18
18	B	188	177	12.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.008	0.605	0.034
C2	-0.008	-0.605	0.034
N3	-0.008	1.968	-0.076
N4	0.008	-1.968	-0.076
H5	-0.328	2.453	0.753
H6	0.851	2.370	-0.429
H7	0.328	-2.453	0.753
H8	-0.851	-2.370	-0.429

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2106	1.3676	2.5759	2.0107	2.0105	3.1576	3.1316
C2	1.2106		2.5759	1.3676	3.1576	3.1316	2.0107	2.0105
N3	1.3676	2.5759		3.9366	1.0121	1.0122	4.5106	4.4341
N4	2.5759	1.3676	3.9366		4.5106	4.4341	1.0121	1.0122
H5	2.0107	3.1576	1.0121	4.5106		1.6718	4.9490	4.9935
H6	2.0105	3.1316	1.0122	4.4341	1.6718		4.9935	5.0373
H7	3.1576	2.0107	4.5106	1.0121	4.9490	4.9935		1.6718
H8	3.1316	2.0105	4.4341	1.0122	4.9935	5.0373	1.6718

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	175.194	C1	N3	H5	114.511
C1	N3	H6	114.482	C2	C1	N3	175.194
C2	N4	H7	114.511	C2	N4	H8	114.482
H5	N3	H6	111.354	H7	N4	H8	111.354

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)