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	hartrees
Energy at 0K	-188.999275
Energy at 298.15K
HF Energy	-188.167116
Nuclear repulsion energy	117.274289

Atom	x (Å)	y (Å)	z (Å)
C1	0.317	0.591	0.032
C2	-0.317	-0.591	0.032
N3	-0.317	1.856	-0.110
N4	0.317	-1.856	-0.110
H5	1.403	0.632	0.032
H6	-1.403	-0.632	0.032
H7	-1.326	1.777	-0.051
H8	1.326	-1.777	-0.051
H9	-0.005	2.513	0.595
H10	0.005	-2.513	0.595

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3410	1.4216	2.4506	1.0866	2.1102	2.0278	2.5756	2.0283	3.1698
C2	1.3410		2.4506	1.4216	2.1102	1.0866	2.5756	2.0278	3.1698	2.0283
N3	1.4216	2.4506		3.7649	2.1149	2.7182	1.0135	3.9875	1.0131	4.4366
N4	2.4506	1.4216	3.7649		2.7182	2.1149	3.9875	1.0135	4.4366	1.0131
H5	1.0866	2.1102	2.1149	2.7182		3.0771	2.9599	2.4124	2.4155	3.4877
H6	2.1102	1.0866	2.7182	2.1149	3.0771		2.4124	2.9599	3.4877	2.4155
H7	2.0278	2.5756	1.0135	3.9875	2.9599	2.4124		4.4346	1.6439	4.5380
H8	2.5756	2.0278	3.9875	1.0135	2.4124	2.9599	4.4346		4.5380	1.6439
H9	2.0283	3.1698	1.0131	4.4366	2.4155	3.4877	1.6439	4.5380		5.0258
H10	3.1698	2.0283	4.4366	1.0131	3.4877	2.4155	4.5380	1.6439	5.0258

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	124.985	C1	C2	H6	120.383
C1	N3	H7	111.669	C1	N3	H9	111.732
C2	C1	N3	124.985	C2	C1	H5	120.383
C2	N4	H8	111.669	C2	N4	H10	111.732
N3	C1	H5	114.296	N4	C2	H6	114.296
H7	N3	H9	108.424	H8	N4	H10	108.424

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

using model chemistry: CCSD(T)/aug-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 H2NCHCHNH2 (diaminoethylene)

using model chemistry: CCSD(T)/aug-cc-pVTZ

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)