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	hartrees
Energy at 0K	-187.674776
Energy at 298.15K	-187.678827
HF Energy	-186.950079
Nuclear repulsion energy	101.739733

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3664	3479	29.47
2	A	3566	3386	2.70
3	A	2377	2257	0.20
4	A	1654	1570	11.13
5	A	1216	1155	0.13
6	A	818	777	9.57
7	A	652	619	99.18
8	A	396	376	2.73
9	A	334	317	28.92
10	A	213	202	16.95
11	B	3665	3479	28.47
12	B	3568	3388	19.81
13	B	1653	1569	27.21
14	B	1363	1294	98.48
15	B	1216	1155	0.13
16	B	703	668	314.94
17	B	397	377	14.40
18	B	214	203	20.19

Atom	x (Å)	y (Å)	z (Å)
C1	0.002	0.606	0.062
C2	-0.002	-0.606	0.062
N3	-0.002	1.956	-0.092
N4	0.002	-1.956	-0.092
H5	-0.319	2.464	0.717
H6	0.860	2.335	-0.448
H7	0.319	-2.464	0.717
H8	-0.860	-2.335	-0.448

	C1	C2	N3	N4	H5	H6	H7	H8
C1		1.2125	1.3587	2.5671	1.9956	1.9961	3.1551	3.1070
C2	1.2125		2.5671	1.3587	3.1551	3.1070	1.9956	1.9961
N3	1.3587	2.5671		3.9123	1.0066	1.0068	4.5049	4.3902
N4	2.5671	1.3587	3.9123		4.5049	4.3902	1.0066	1.0068
H5	1.9956	3.1551	1.0066	4.5049		1.6631	4.9687	4.9674
H6	1.9961	3.1070	1.0068	4.3902	1.6631		4.9674	4.9762
H7	3.1551	1.9956	4.5049	1.0066	4.9687	4.9674		1.6631
H8	3.1070	1.9961	4.3902	1.0068	4.9674	4.9762	1.6631

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	173.463	C1	N3	H5	114.238
C1	N3	H6	114.274	C2	C1	N3	173.463
C2	N4	H7	114.238	C2	N4	H8	114.274
H5	N3	H6	111.383	H7	N4	H8	111.383

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)

using model chemistry: MP2/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: MP2/cc-pVTZ

States and conformations

All results from a given calculation for NH₂CCNH₂ (Diaminoacetylene)