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	hartrees
Energy at 0K	-28.803376
Energy at 298.15K	-28.811443
HF Energy	-28.331766
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	50.064883

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3492	3327	2.28
2	A₁	3111	2965	39.41
3	A₁	1724	1642	71.78
4	A₁	1519	1448	0.43
5	A₁	1133	1079	36.83
6	A₁	903	860	0.00
7	A₁	458	436	6.44
8	A₂	3601	3431	0.00
9	A₂	1412	1345	0.00
10	A₂	1086	1034	0.00
11	A₂	274	261	0.00
12	B₁	3598	3428	0.05
13	B₁	3179	3029	29.94
14	B₁	1402	1336	0.64
15	B₁	860	820	1.73
16	B₁	413	394	111.39
17	B₂	3493	3328	0.54
18	B₂	1712	1631	2.57
19	B₂	1413	1346	31.16
20	B₂	1096	1044	84.04
21	B₂	855	814	468.20

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.559
N2	0.000	1.274	-0.185
N3	0.000	-1.274	-0.185
H4	0.885	0.000	1.202
H5	-0.885	0.000	1.202
H6	0.821	1.318	-0.791
H7	-0.821	1.318	-0.791
H8	-0.821	-1.318	-0.791
H9	0.821	-1.318	-0.791

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4755	1.4755	1.0939	1.0939	2.0576	2.0576	2.0576	2.0576
N2	1.4755		2.5482	2.0811	2.0811	1.0211	1.0211	2.7856	2.7856
N3	1.4755	2.5482		2.0811	2.0811	2.7856	2.7856	1.0211	1.0211
H4	1.0939	2.0811	2.0811		1.7695	2.3907	2.9359	2.9359	2.3907
H5	1.0939	2.0811	2.0811	1.7695		2.9359	2.3907	2.3907	2.9359
H6	2.0576	1.0211	2.7856	2.3907	2.9359		1.6411	3.1051	2.6360
H7	2.0576	1.0211	2.7856	2.9359	2.3907	1.6411		2.6360	3.1051
H8	2.0576	2.7856	1.0211	2.9359	2.3907	3.1051	2.6360		1.6411
H9	2.0576	2.7856	1.0211	2.3907	2.9359	2.6360	3.1051	1.6411

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	109.663	C1	N2	H7	109.663
C1	N3	H8	109.663	C1	N3	H9	109.663
N2	C1	N3	119.424	N2	C1	H4	107.252
N2	C1	H5	107.252	N3	C1	H4	107.252
N3	C1	H5	107.252	H4	C1	H5	107.964
H6	N2	H7	106.955	H8	N3	H9	106.955

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2/CEP-121G*

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 NH2CH2NH2 (diaminomethane)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)