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	hartrees
Energy at 0K	-170.889455
Energy at 298.15K	-170.896079
HF Energy	-170.889455
Nuclear repulsion energy	82.356839

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3796	3610	10.36
2	A	3613	3436	0.86
3	A	3520	3348	0.50
4	A	3151	2996	33.46
5	A	3059	2909	68.30
6	A	1712	1629	26.50
7	A	1530	1455	0.11
8	A	1447	1376	48.65
9	A	1410	1341	1.40
10	A	1400	1331	2.80
11	A	1186	1128	30.06
12	A	1134	1078	26.96
13	A	1053	1002	238.92
14	A	920	875	3.18
15	A	860	818	169.49
16	A	482	458	53.30
17	A	430	409	119.67
18	A	309	294	71.57

Atom	x (Å)	y (Å)	z (Å)
N1	1.226	-0.156	-0.021
C2	-0.033	0.531	0.048
O3	-1.197	-0.262	-0.116
H4	1.269	-0.713	-0.869
H5	1.342	-0.792	0.763
H6	-0.063	1.083	0.998
H7	-0.077	1.257	-0.767
H8	-1.277	-0.832	0.661

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4352	2.4272	1.0161	1.0161	2.0575	2.0618	2.6801
C2	1.4352		1.4182	2.0204	2.0372	1.0991	1.0931	1.9441
O3	2.4272	1.4182		2.6177	2.7386	2.0825	1.9971	0.9667
H4	1.0161	2.0204	2.6177		1.6362	2.9130	2.3879	2.9723
H5	1.0161	2.0372	2.7386	1.6362		2.3548	2.9248	2.6205
H6	2.0575	1.0991	2.0825	2.9130	2.3548		1.7737	2.2924
H7	2.0618	1.0931	1.9971	2.3879	2.9248	1.7737		2.8008
H8	2.6801	1.9441	0.9667	2.9723	2.6205	2.2924	2.8008

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.552	N1	C2	H6	107.815
N1	C2	H7	108.516	C2	N1	H4	109.837
C2	N1	H5	111.263	C2	O3	H8	107.704
O3	C2	H6	111.000	O3	C2	H7	104.611
H4	N1	H5	107.243	H6	C2	H7	108.016

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: HSEh1PBE/6-31G*

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	-0.730
2	C	-0.015
3	O	-0.618
4	H	0.323
5	H	0.309
6	H	0.157
7	H	0.185
8	H	0.390

	x	y	z	Total
	0.215	-1.294	1.311	1.854
CHELPG
AIM
ESP

	x	y	z
x	3.364	-0.121	-0.087
y	-0.121	3.201	-0.184
z	-0.087	-0.184	3.297

<r²>	49.317
(<r²>)^1/2	7.023

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: HSEh1PBE/6-31G*

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)