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	hartrees
Energy at 0K	-187.485915
Energy at 298.15K	-187.489751
HF Energy	-186.866153
Nuclear repulsion energy	100.851420

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3588	3442
2	A	3496	3354
3	A	2364	2268
4	A	1701	1632
5	A	1237	1186
6	A	822	788
7	A	706	677
8	A	383	367
9	A	321	308
10	A	192	185
11	B	3588	3442
12	B	3499	3357
13	B	1702	1633
14	B	1344	1289
15	B	1233	1183
16	B	768	737
17	B	320	307
18	B	152	146

Atom	x (Å)	y (Å)	z (Å)
C1	0.076	0.605	-0.021
C2	-0.076	-0.605	-0.021
N3	0.076	1.983	-0.051
N4	-0.076	-1.983	-0.051
H5	-0.180	2.397	0.843
H6	0.966	2.367	-0.363
H7	0.180	-2.397	0.843
H8	-0.966	-2.367	-0.363

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2202	1.3775	2.5926	2.0057	2.0033	3.1263	3.1682
C2	1.2202		2.5926	1.3775	3.1263	3.1682	2.0057	2.0033
N3	1.3775	2.5926		3.9681	1.0184	1.0185	4.4716	4.4835
N4	2.5926	1.3775	3.9681		4.4716	4.4835	1.0184	1.0185
H5	2.0057	3.1263	1.0184	4.4716		1.6642	4.8084	4.9772
H6	2.0033	3.1682	1.0185	4.4835	1.6642		4.9772	5.1130
H7	3.1263	2.0057	4.4716	1.0184	4.8084	4.9772		1.6642
H8	3.1682	2.0033	4.4835	1.0185	4.9772	5.1130	1.6642

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	172.772	C1	N3	H5	112.815
C1	N3	H6	112.598	C2	C1	N3	172.772
C2	N4	H7	112.815	C2	N4	H8	112.598
H5	N3	H6	109.570	H7	N4	H8	109.570

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

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

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)