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	hartrees
Energy at 0K	-170.109956
Energy at 298.15K	-170.116631
HF Energy	-170.109956
Nuclear repulsion energy	82.896098

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4163	3791	44.51
2	A	3813	3472	5.15
3	A	3726	3393	2.63
4	A	3275	2982	38.79
5	A	3200	2914	67.04
6	A	1788	1628	34.24
7	A	1621	1476	0.10
8	A	1535	1398	54.39
9	A	1490	1357	0.29
10	A	1474	1343	10.28
11	A	1244	1132	61.22
12	A	1181	1075	47.27
13	A	1125	1025	222.18
14	A	978	890	2.29
15	A	895	815	132.95
16	A	515	469	45.26
17	A	398	362	95.51
18	A	286	261	81.39

Atom	x (Å)	y (Å)	z (Å)
N1	1.215	-0.158	-0.017
C2	-0.037	0.535	0.047
O3	-1.185	-0.265	-0.114
H4	1.295	-0.689	-0.864
H5	1.347	-0.782	0.757
H6	-0.083	1.074	0.995
H7	-0.079	1.259	-0.762
H8	-1.287	-0.843	0.625

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4332	2.4046	1.0026	1.0026	2.0561	2.0588	2.6727
C2	1.4332		1.4090	2.0258	2.0382	1.0905	1.0859	1.9482
O3	2.4046	1.4090		2.6252	2.7267	2.0584	1.9909	0.9432
H4	1.0026	2.0258	2.6252		1.6247	2.9087	2.3856	2.9848
H5	1.0026	2.0382	2.7267	1.6247		2.3549	2.9162	2.6380
H6	2.0561	1.0905	2.0584	2.9087	2.3549		1.7659	2.2935
H7	2.0588	1.0859	1.9909	2.3856	2.9162	1.7659		2.7921
H8	2.6727	1.9482	0.9432	2.9848	2.6380	2.2935	2.7921

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	115.564	N1	C2	H6	108.359
N1	C2	H7	108.848	C2	N1	H4	111.310
C2	N1	H5	112.399	C2	O3	H8	110.272
O3	C2	H6	110.234	O3	C2	H7	105.144
H4	N1	H5	108.230	H6	C2	H7	108.465

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: HF/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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Number	Element	Mulliken
1	N	-0.332
2	C	1.218
3	O	-0.614
4	H	-0.019
5	H	-0.031
6	H	-0.139
7	H	-0.175
8	H	0.093

	x	y	z	Total
	0.301	-1.034	1.289	1.680
CHELPG
AIM
ESP

	x	y	z
x	4.318	0.027	-0.042
y	0.027	4.001	-0.059
z	-0.042	-0.059	3.786

<r²>	49.215
(<r²>)^1/2	7.015

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)