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	hartrees
Energy at 0K	-171.093401
Energy at 298.15K	-171.099881
HF Energy	-171.093401
Nuclear repulsion energy	81.080809

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3641	3632	6.95
2	A	3482	3473	0.98
3	A	3397	3388	0.62
4	A	3036	3028	26.91
5	A	2954	2947	57.69
6	A	1631	1627	28.12
7	A	1459	1455	0.12
8	A	1387	1383	30.56
9	A	1348	1345	2.08
10	A	1322	1318	3.44
11	A	1123	1120	25.73
12	A	1049	1046	31.44
13	A	888	886	56.81
14	A	884	881	191.57
15	A	756	754	173.18
16	A	458	457	51.34
17	A	413	412	92.56
18	A	287	286	74.98

Atom	x (Å)	y (Å)	z (Å)
N1	1.242	-0.165	-0.022
C2	-0.021	0.539	0.048
O3	-1.230	-0.262	-0.116
H4	1.320	-0.716	-0.878
H5	1.399	-0.777	0.779
H6	-0.054	1.086	1.003
H7	-0.073	1.258	-0.777
H8	-1.317	-0.835	0.668

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4471	2.4751	1.0211	1.0209	2.0716	2.0789	2.7339
C2	1.4471		1.4594	2.0566	2.0696	1.1008	1.0954	1.9885
O3	2.4751	1.4594		2.6994	2.8242	2.1101	2.0217	0.9752
H4	1.0211	2.0566	2.6994		1.6602	2.9445	2.4182	3.0591
H5	1.0209	2.0696	2.8242	1.6602		2.3731	2.9546	2.7190
H6	2.0716	1.1008	2.1101	2.9445	2.3731		1.7876	2.3241
H7	2.0789	1.0954	2.0217	2.4182	2.9546	1.7876		2.8320
H8	2.7339	1.9885	0.9752	3.0591	2.7190	2.3241	2.8320

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.765	N1	C2	H6	108.022
N1	C2	H7	108.910	C2	N1	H4	111.706
C2	N1	H5	112.841	C2	O3	H8	107.864
O3	C2	H6	110.227	O3	C2	H7	103.704
H4	N1	H5	108.785	H6	C2	H7	108.961

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: BLYP/TZVP

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	-0.389
2	C	-0.116
3	O	-0.368
4	H	0.196
5	H	0.189
6	H	0.119
7	H	0.133
8	H	0.235

	x	y	z	Total
	0.549	-1.083	1.330	1.801
CHELPG
AIM
ESP

	x	y	z
x	4.593	-0.030	-0.109
y	-0.030	4.017	-0.143
z	-0.109	-0.143	3.924

<r²>	51.247
(<r²>)^1/2	7.159

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: BLYP/TZVP

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)