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	hartrees
Energy at 0K	-170.096470
Energy at 298.15K	-170.103176
HF Energy	-170.096470
Nuclear repulsion energy	83.216639

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4171	3777	35.90
2	A	3818	3457	3.24
3	A	3733	3380	1.28
4	A	3254	2947	46.23
5	A	3178	2878	75.21
6	A	1805	1634	30.33
7	A	1642	1487	0.55
8	A	1555	1408	57.70
9	A	1506	1364	0.46
10	A	1495	1354	10.65
11	A	1253	1134	36.18
12	A	1190	1078	75.86
13	A	1144	1036	200.65
14	A	983	890	2.65
15	A	919	832	145.09
16	A	519	470	45.21
17	A	406	368	104.12
18	A	302	273	74.40

Atom	x (Å)	y (Å)	z (Å)
N1	1.213	-0.156	-0.018
C2	-0.041	0.534	0.047
O3	-1.178	-0.266	-0.113
H4	1.277	-0.693	-0.859
H5	1.335	-0.779	0.755
H6	-0.083	1.074	0.989
H7	-0.082	1.256	-0.759
H8	-1.267	-0.842	0.625

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4326	2.3959	0.9997	0.9997	2.0512	2.0542	2.6521
C2	1.4326		1.4000	2.0154	2.0290	1.0871	1.0822	1.9320
O3	2.3959	1.4000		2.6017	2.7079	2.0519	1.9837	0.9406
H4	0.9997	2.0154	2.6017		1.6168	2.8961	2.3782	2.9487
H5	0.9997	2.0290	2.7079	1.6168		2.3449	2.9047	2.6056
H6	2.0512	1.0871	2.0519	2.8961	2.3449		1.7570	2.2821
H7	2.0542	1.0822	1.9837	2.3782	2.9047	1.7570		2.7787
H8	2.6521	1.9320	0.9406	2.9487	2.6056	2.2821	2.7787

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	115.519	N1	C2	H6	108.213
N1	C2	H7	108.746	C2	N1	H4	110.653
C2	N1	H5	111.833	C2	O3	H8	109.708
O3	C2	H6	110.552	O3	C2	H7	105.385
H4	N1	H5	107.931	H6	C2	H7	108.180

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: HF/6-31G(2df,p)

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	-0.634
2	C	0.098
3	O	-0.563
4	H	0.268
5	H	0.257
6	H	0.117
7	H	0.141
8	H	0.317

	x	y	z	Total
	0.232	-1.134	1.253	1.706
CHELPG
AIM
ESP

	x	y	z
x	3.293	-0.117	-0.071
y	-0.117	3.254	-0.133
z	-0.071	-0.133	3.278

<r²>	48.531
(<r²>)^1/2	6.966

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: HF/6-31G(2df,p)

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)