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	hartrees
Energy at 0K	-188.807953
Energy at 298.15K
HF Energy	-188.121933
Nuclear repulsion energy	116.762292

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3640	3640	2.41
2	A	3544	3544	0.09
3	A	3200	3200	0.08
4	A	1783	1783	0.15
5	A	1649	1649	19.68
6	A	1341	1341	0.51
7	A	1291	1291	0.08
8	A	1047	1047	0.36
9	A	943	943	69.04
10	A	822	822	102.74
11	A	551	551	1.44
12	A	309	309	1.70
13	A	245	245	15.11
14	B	3640	3640	6.32
15	B	3543	3543	4.22
16	B	3202	3202	41.75
17	B	1658	1658	49.56
18	B	1399	1399	9.46
19	B	1182	1182	97.60
20	B	1135	1135	0.40
21	B	823	823	153.96
22	B	757	757	174.72
23	B	333	333	26.47
24	B	241	241	97.42

Atom	x (Å)	y (Å)	z (Å)
C1	0.318	0.594	0.031
C2	-0.318	-0.594	0.031
N3	-0.318	1.864	-0.109
N4	0.318	-1.864	-0.109
H5	1.412	0.637	0.032
H6	-1.412	-0.637	0.032
H7	-1.331	1.783	-0.066
H8	1.331	-1.783	-0.066
H9	-0.019	2.514	0.613
H10	0.019	-2.514	0.613

	C1	C2	N3	N4	H5	H6	H7	H8	H9	H10
C1		1.3481	1.4272	2.4622	1.0949	2.1236	2.0347	2.5854	2.0338	3.1760
C2	1.3481		2.4622	1.4272	2.1236	1.0949	2.5854	2.0347	3.1760	2.0338
N3	1.4272	2.4622		3.7819	2.1259	2.7334	1.0167	4.0023	1.0166	4.4495
N4	2.4622	1.4272	3.7819		2.7334	2.1259	4.0023	1.0167	4.4495	1.0166
H5	1.0949	2.1236	2.1259	2.7334		3.0984	2.9741	2.4230	2.4305	3.4936
H6	2.1236	1.0949	2.7334	2.1259	3.0984		2.4230	2.9741	3.4936	2.4305
H7	2.0347	2.5854	1.0167	4.0023	2.9741	2.4230		4.4490	1.6481	4.5540
H8	2.5854	2.0347	4.0023	1.0167	2.4230	2.9741	4.4490		4.5540	1.6481
H9	2.0338	3.1760	1.0166	4.4495	2.4305	3.4936	1.6481	4.5540		5.0273
H10	3.1760	2.0338	4.4495	1.0166	3.4936	2.4305	4.5540	1.6481	5.0273

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N4	125.026	C1	C2	H6	120.400
C1	N3	H7	111.629	C1	N3	H9	111.553
C2	C1	N3	125.026	C2	C1	H5	120.400
C2	N4	H8	111.629	C2	N4	H10	111.553
N3	C1	H5	114.257	N4	C2	H6	114.257
H7	N3	H9	108.299	H8	N4	H10	108.299

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)

using model chemistry: MP3=FULL/aug-cc-pVDZ

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: MP3=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for H₂NCHCHNH₂ (diaminoethylene)