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	hartrees
Energy at 0K	-150.869354
Energy at 298.15K	-150.877455
HF Energy	-150.288108
Counterpoise corrected energy	-150.869354
CP Energy at 298.15K	-150.877455
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	83.282304

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3538	3356	0.82
2	A₁	3113	2953	38.43
3	A₁	1665	1579	46.62
4	A₁	1511	1433	0.16
5	A₁	1142	1083	34.60
6	A₁	903	857	0.23
7	A₁	459	436	6.19
8	A₂	3636	3449	0.00
9	A₂	1424	1351	0.00
10	A₂	1092	1036	0.00
11	A₂	280	266	0.00
12	B₁	3633	3446	0.20
13	B₁	3169	3006	27.23
14	B₁	1393	1321	1.05
15	B₁	870	825	1.62
16	B₁	422	400	96.50
17	B₂	3538	3356	0.65
18	B₂	1660	1575	2.75
19	B₂	1417	1344	23.40
20	B₂	1123	1065	69.14
21	B₂	839	796	417.15

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.556
N2	0.000	1.258	-0.184
N3	0.000	-1.258	-0.184
H4	0.880	0.000	1.204
H5	-0.880	0.000	1.204
H6	0.813	1.296	-0.791
H7	-0.813	1.296	-0.791
H8	-0.813	-1.296	-0.791
H9	0.813	-1.296	-0.791

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4592	1.4592	1.0928	1.0928	2.0382	2.0382	2.0382	2.0382
N2	1.4592		2.5155	2.0693	2.0693	1.0150	1.0150	2.7481	2.7481
N3	1.4592	2.5155		2.0693	2.0693	2.7481	2.7481	1.0150	1.0150
H4	1.0928	2.0693	2.0693		1.7601	2.3796	2.9196	2.9196	2.3796
H5	1.0928	2.0693	2.0693	1.7601		2.9196	2.3796	2.3796	2.9196
H6	2.0382	1.0150	2.7481	2.3796	2.9196		1.6256	3.0602	2.5927
H7	2.0382	1.0150	2.7481	2.9196	2.3796	1.6256		2.5927	3.0602
H8	2.0382	2.7481	1.0150	2.9196	2.3796	3.0602	2.5927		1.6256
H9	2.0382	2.7481	1.0150	2.3796	2.9196	2.5927	3.0602	1.6256

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	109.625	C1	N2	H7	109.625
C1	N3	H8	109.625	C1	N3	H9	109.625
N2	C1	N3	119.066	N2	C1	H4	107.492
N2	C1	H5	107.492	N3	C1	H4	107.492
N3	C1	H5	107.492	H4	C1	H5	107.291
H6	N2	H7	106.415	H8	N3	H9	106.415

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2=FULL/6-311G**

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=FULL/6-311G**

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)