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	hartrees
Energy at 0K	-170.039090
Energy at 298.15K	-170.045695
HF Energy	-170.039090
Nuclear repulsion energy	81.011479

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3628	3478	4.30
2	A	3521	3376	0.80
3	A	3518	3373	1.40
4	A	3136	3007	23.17
5	A	3042	2916	54.25
6	A	1722	1651	31.69
7	A	1555	1491	0.61
8	A	1452	1392	22.07
9	A	1416	1357	0.58
10	A	1375	1318	9.87
11	A	1178	1130	35.62
12	A	1125	1078	40.75
13	A	984	943	170.89
14	A	899	862	7.78
15	A	643	617	237.66
16	A	468	449	64.67
17	A	437	419	234.13
18	A	373	358	43.71

Atom	x (Å)	y (Å)	z (Å)
N1	1.227	-0.173	-0.025
C2	-0.024	0.537	0.053
O3	-1.239	-0.256	-0.112
H4	1.386	-0.663	-0.904
H5	1.478	-0.733	0.788
H6	-0.040	1.085	1.002
H7	-0.076	1.255	-0.765
H8	-1.280	-0.911	0.634

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4415	2.4696	1.0184	1.0188	2.0599	2.0705	2.6955
C2	1.4415		1.4603	2.0844	2.1003	1.0957	1.0895	2.0028
O3	2.4696	1.4603		2.7719	2.9013	2.1158	2.0158	0.9929
H4	1.0184	2.0844	2.7719		1.6955	2.9528	2.4158	3.0872
H5	1.0188	2.1003	2.9013	1.6955		2.3782	2.9634	2.7674
H6	2.0599	1.0957	2.1158	2.9528	2.3782		1.7754	2.3785
H7	2.0705	1.0895	2.0158	2.4158	2.9634	1.7754		2.8456
H8	2.6955	2.0028	0.9929	3.0872	2.7674	2.3785	2.8456

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.656	N1	C2	H6	107.782
N1	C2	H7	108.987	C2	N1	H4	114.762
C2	N1	H5	116.178	C2	O3	H8	107.933
O3	C2	H6	110.946	O3	C2	H7	103.518
H4	N1	H5	112.670	H6	C2	H7	108.677

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: M06-2X/3-21G

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	-0.008
3	O	-0.584
4	H	0.292
5	H	0.280
6	H	0.192
7	H	0.229
8	H	0.329

	x	y	z	Total
	0.865	-1.302	1.380	2.085
CHELPG
AIM
ESP

	x	y	z
x	2.977	-0.105	-0.071
y	-0.105	2.691	-0.288
z	-0.071	-0.288	2.920

<r²>	50.798
(<r²>)^1/2	7.127

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: M06-2X/3-21G

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)