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	hartrees
Energy at 0K	-171.004709
Energy at 298.15K	-171.011012
HF Energy	-171.004709
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3813	3813	12.58
2	A	3770	3770	3.31
3	A	3672	3672	6.86
4	A	3204	3204	38.87
5	A	3101	3101	80.69
6	A	1705	1705	59.08
7	A	1529	1529	2.99
8	A	1454	1454	26.03
9	A	1379	1379	3.56
10	A	1336	1336	16.68
11	A	1194	1194	98.23
12	A	1123	1123	16.64
13	A	952	952	242.88
14	A	911	911	7.42
15	A	558	558	184.14
16	A	419	419	178.91
17	A	393	393	83.32
18	A	251	251	223.54

Atom	x (Å)	y (Å)	z (Å)
N1	1.206	-0.194	-0.027
C2	-0.019	0.543	0.042
O3	-1.245	-0.255	-0.095
H4	1.449	-0.640	-0.897
H5	1.588	-0.604	0.810
H6	-0.043	1.097	0.988
H7	-0.092	1.246	-0.787
H8	-1.272	-0.956	0.581

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4310	2.4520	1.0077	1.0074	2.0628	2.0824	2.6619
C2	1.4310		1.4687	2.1064	2.1188	1.0967	1.0898	2.0265
O3	2.4520	1.4687		2.8368	2.9946	2.1085	2.0148	0.9750
H4	1.0077	2.1064	2.8368		1.7130	2.9659	2.4382	3.1121
H5	1.0074	2.1188	2.9946	1.7130		2.3632	2.9662	2.8904
H6	2.0628	1.0967	2.1085	2.9659	2.3632		1.7826	2.4271
H7	2.0824	1.0898	2.0148	2.4382	2.9662	1.7826		2.8485
H8	2.6619	2.0265	0.9750	3.1121	2.8904	2.4271	2.8485

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	115.463	N1	C2	H6	108.666
N1	C2	H7	110.675	C2	N1	H4	118.443
C2	N1	H5	119.657	C2	O3	H8	110.414
O3	C2	H6	109.694	O3	C2	H7	102.901
H4	N1	H5	116.450	H6	C2	H7	109.232

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: wB97X-D/LANL2DZ

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	-0.658
2	C	-0.221
3	O	-0.507
4	H	0.318
5	H	0.307
6	H	0.195
7	H	0.224
8	H	0.341

	x	y	z	Total
	1.642	-1.114	1.505	2.491
CHELPG
AIM
ESP

	x	y	z
x	3.343	-0.102	0.015
y	-0.102	2.916	-0.216
z	0.015	-0.216	3.042

<r²>	50.971
(<r²>)^1/2	7.139

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: wB97X-D/LANL2DZ

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)