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	hartrees
Energy at 0K	-150.934773
Energy at 298.15K	-150.942748
HF Energy	-150.309171
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	83.291445

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3520	3354	0.03
2	A₁	3101	2955	26.49
3	A₁	1660	1582	43.90
4	A₁	1509	1438	0.18
5	A₁	1102	1050	35.83
6	A₁	846	806	3.16
7	A₁	455	434	2.18
8	A₂	3621	3451	0.00
9	A₂	1408	1342	0.00
10	A₂	1073	1022	0.00
11	A₂	257	245	0.00
12	B₁	3618	3448	8.80
13	B₁	3158	3009	17.58
14	B₁	1371	1306	0.51
15	B₁	851	811	0.62
16	B₁	377	359	81.88
17	B₂	3521	3355	4.41
18	B₂	1649	1571	6.73
19	B₂	1393	1328	16.88
20	B₂	1099	1047	85.77
21	B₂	781	744	371.72

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.553
N2	0.000	1.257	-0.184
N3	0.000	-1.257	-0.184
H4	0.878	0.000	1.198
H5	-0.878	0.000	1.198
H6	0.815	1.322	-0.783
H7	-0.815	1.322	-0.783
H8	-0.815	-1.322	-0.783
H9	0.815	-1.322	-0.783

	C1	N2	N3	H4	H5	H6	H7	H8	H9
C1		1.4578	1.4578	1.0889	1.0889	2.0484	2.0484	2.0484	2.0484
N2	1.4578		2.5150	2.0643	2.0643	1.0131	1.0131	2.7703	2.7703
N3	1.4578	2.5150		2.0643	2.0643	2.7703	2.7703	1.0131	1.0131
H4	1.0889	2.0643	2.0643		1.7551	2.3821	2.9213	2.9213	2.3821
H5	1.0889	2.0643	2.0643	1.7551		2.9213	2.3821	2.3821	2.9213
H6	2.0484	1.0131	2.7703	2.3821	2.9213		1.6294	3.1053	2.6435
H7	2.0484	1.0131	2.7703	2.9213	2.3821	1.6294		2.6435	3.1053
H8	2.0484	2.7703	1.0131	2.9213	2.3821	3.1053	2.6435		1.6294
H9	2.0484	2.7703	1.0131	2.3821	2.9213	2.6435	3.1053	1.6294

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H6	110.713	C1	N2	H7	110.713
C1	N3	H8	110.713	C1	N3	H9	110.713
N2	C1	N3	119.217	N2	C1	H4	107.427
N2	C1	H5	107.427	N3	C1	H4	107.427
N3	C1	H5	107.427	H4	C1	H5	107.404
H6	N2	H7	107.067	H8	N3	H9	107.067

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)

using model chemistry: MP2/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 NH2CH2NH2 (diaminomethane)

using model chemistry: MP2/aug-cc-pVTZ

States and conformations

All results from a given calculation for NH₂CH₂NH₂ (diaminomethane)