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	hartrees
Energy at 0K	-169.943834
Energy at 298.15K	-169.950352
HF Energy	-169.943834
Nuclear repulsion energy	81.076894

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3607	3462	2.10
2	A	3517	3376	1.95
3	A	3498	3358	0.38
4	A	3149	3023	29.23
5	A	3047	2925	70.15
6	A	1731	1661	28.40
7	A	1550	1488	0.91
8	A	1437	1379	21.36
9	A	1415	1358	0.85
10	A	1382	1326	7.00
11	A	1179	1132	29.90
12	A	1119	1074	41.19
13	A	958	919	176.94
14	A	904	868	6.28
15	A	639	614	238.45
16	A	452	434	69.47
17	A	434	417	159.17
18	A	323	310	98.64

Atom	x (Å)	y (Å)	z (Å)
N1	1.228	-0.172	-0.026
C2	-0.021	0.533	0.052
O3	-1.241	-0.254	-0.112
H4	1.376	-0.670	-0.901
H5	1.469	-0.736	0.786
H6	-0.030	1.086	1.001
H7	-0.075	1.252	-0.767
H8	-1.279	-0.897	0.643

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4359	2.4722	1.0175	1.0176	2.0544	2.0672	2.6939
C2	1.4359		1.4616	2.0748	2.0898	1.0985	1.0912	1.9943
O3	2.4722	1.4616		2.7652	2.8956	2.1217	2.0144	0.9926
H4	1.0175	2.0748	2.7652		1.6907	2.9459	2.4115	3.0794
H5	1.0176	2.0898	2.8956	1.6907		2.3695	2.9574	2.7561
H6	2.0544	1.0985	2.1217	2.9459	2.3695		1.7761	2.3711
H7	2.0672	1.0912	2.0144	2.4115	2.9574	1.7761		2.8385
H8	2.6939	1.9943	0.9926	3.0794	2.7561	2.3711	2.8385

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	117.131	N1	C2	H6	107.568
N1	C2	H7	109.011	C2	N1	H4	114.419
C2	N1	H5	115.762	C2	O3	H8	107.155
O3	C2	H6	111.153	O3	C2	H7	103.245
H4	N1	H5	112.357	H6	C2	H7	108.406

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: HSEh1PBE/3-21G*

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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Number	Element	Mulliken
1	N	-0.727
2	C	-0.062
3	O	-0.568
4	H	0.297
5	H	0.286
6	H	0.204
7	H	0.243
8	H	0.327

	x	y	z	Total
	0.852	-1.343	1.347	2.084
CHELPG
AIM
ESP

	x	y	z
x	3.068	-0.101	-0.075
y	-0.101	2.727	-0.267
z	-0.075	-0.267	2.961

<r²>	50.676
(<r²>)^1/2	7.119

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: HSEh1PBE/3-21G*

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)