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	hartrees
Energy at 0K	-187.510752
Energy at 298.15K	-187.514735
HF Energy	-186.893628
Nuclear repulsion energy	101.469942

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3752	3491	30.44
2	A	3653	3399	1.94
3	A	2441	2271	0.01
4	A	1712	1593	15.16
5	A	1243	1156	0.11
6	A	835	777	8.44
7	A	672	625	131.25
8	A	425	395	1.43
9	A	347	323	34.46
10	A	208	194	16.99
11	B	3752	3491	27.22
12	B	3655	3401	18.91
13	B	1713	1594	42.65
14	B	1367	1272	103.22
15	B	1239	1153	0.89
16	B	719	669	344.10
17	B	347	323	18.66
18	B	174	162	16.11

Atom	x (Å)	y (Å)	z (Å)
C1	0.009	0.606	0.039
C2	-0.009	-0.606	0.039
N3	-0.009	1.969	-0.076
N4	0.009	-1.969	-0.076
H5	-0.342	2.459	0.739
H6	0.837	2.376	-0.441
H7	0.342	-2.459	0.739
H8	-0.837	-2.376	-0.441

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2113	1.3685	2.5774	2.0125	2.0126	3.1615	3.1364
C2	1.2113		2.5774	1.3685	3.1615	3.1364	2.0125	2.0126
N3	1.3685	2.5774		3.9385	1.0075	1.0076	4.5165	4.4386
N4	2.5774	1.3685	3.9385		4.5165	4.4386	1.0075	1.0076
H5	2.0125	3.1615	1.0075	4.5165		1.6706	4.9658	5.0020
H6	2.0126	3.1364	1.0076	4.4386	1.6706		5.0020	5.0385
H7	3.1615	2.0125	4.5165	1.0075	4.9658	5.0020		1.6706
H8	3.1364	2.0126	4.4386	1.0076	5.0020	5.0385	1.6706

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	174.945	C1	N3	H5	114.933
C1	N3	H6	114.927	C2	C1	N3	174.945
C2	N4	H7	114.933	C2	N4	H8	114.927
H5	N3	H6	112.007	H7	N4	H8	112.007

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: MP3/6-31+G**

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: MP3/6-31+G**

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)