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	hartrees
Energy at 0K	-170.936396
Energy at 298.15K	-170.942838
HF Energy	-170.936396
Nuclear repulsion energy	81.549237

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3780	3780	15.24
2	A	3705	3705	4.07
3	A	3652	3652	8.39
4	A	3177	3177	30.17
5	A	3084	3084	60.06
6	A	1710	1710	50.46
7	A	1547	1547	0.87
8	A	1455	1455	26.98
9	A	1398	1398	2.02
10	A	1356	1356	15.15
11	A	1199	1199	97.15
12	A	1136	1136	12.35
13	A	980	980	218.61
14	A	903	903	4.83
15	A	583	583	221.56
16	A	438	438	114.96
17	A	427	427	127.56
18	A	295	295	203.21

Atom	x (Å)	y (Å)	z (Å)
N1	1.200	-0.190	-0.026
C2	-0.022	0.537	0.045
O3	-1.235	-0.254	-0.099
H4	1.443	-0.630	-0.898
H5	1.569	-0.622	0.804
H6	-0.044	1.088	0.991
H7	-0.089	1.249	-0.776
H8	-1.270	-0.946	0.587

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4234	2.4368	1.0067	1.0064	2.0531	2.0725	2.6555
C2	1.4234		1.4553	2.0968	2.1099	1.0950	1.0890	2.0133
O3	2.4368	1.4553		2.8193	2.9689	2.0991	2.0072	0.9757
H4	1.0067	2.0968	2.8193		1.7072	2.9550	2.4275	3.1093
H5	1.0064	2.1099	2.9689	1.7072		2.3586	2.9581	2.8663
H6	2.0531	1.0950	2.0991	2.9550	2.3586		1.7753	2.4090
H7	2.0725	1.0890	2.0072	2.4275	2.9581	1.7753		2.8413
H8	2.6555	2.0133	0.9757	3.1093	2.8663	2.4090	2.8413

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	115.661	N1	C2	H6	108.519
N1	C2	H7	110.451	C2	N1	H4	118.258
C2	N1	H5	119.549	C2	O3	H8	110.264
O3	C2	H6	109.988	O3	C2	H7	103.230
H4	N1	H5	116.000	H6	C2	H7	108.756

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: M06-2X/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	-0.763
2	C	0.071
3	O	-0.635
4	H	0.323
5	H	0.313
6	H	0.151
7	H	0.185
8	H	0.355

	x	y	z	Total
	1.515	-1.141	1.464	2.396
CHELPG
AIM
ESP

	x	y	z
x	3.295	-0.092	-0.020
y	-0.092	2.869	-0.240
z	-0.020	-0.240	3.033

<r²>	50.539
(<r²>)^1/2	7.109

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: M06-2X/6-31G

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)