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	hartrees
Energy at 0K	-190.409887
Energy at 298.15K	-190.415204
HF Energy	-189.898137
Nuclear repulsion energy	81.309035

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3755	3546	17.06
2	A	3080	2908	58.31
3	A	1588	1499	1.65
4	A	1436	1356	5.51
5	A	1241	1172	1.09
6	A	1077	1017	112.65
7	A	586	553	105.58
8	A	416	393	38.72
9	B	3754	3545	28.13
10	B	3133	2959	58.69
11	B	1492	1409	95.29
12	B	1416	1337	21.46
13	B	1139	1076	211.04
14	B	1040	982	23.36
15	B	416	392	212.90

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.536
O2	0.000	1.170	-0.248
O3	0.000	-1.170	-0.248
H4	-0.894	-0.078	1.167
H5	0.894	0.078	1.167
H6	-0.806	1.144	-0.792
H7	0.806	-1.144	-0.792

	C1	O2	O3	H4	H5	H6	H7
C1		1.4084	1.4084	1.0969	1.0969	1.9289	1.9289
O2	1.4084		2.3405	2.0877	1.9987	0.9728	2.5098
O3	1.4084	2.3405		1.9987	2.0877	2.5098	0.9728
H4	1.0969	2.0877	1.9987		1.7940	2.3105	2.8042
H5	1.0969	1.9987	2.0877	1.7940		2.8042	2.3105
H6	1.9289	0.9728	2.5098	2.3105	2.8042		2.7980
H7	1.9289	2.5098	0.9728	2.8042	2.3105	2.7980

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	106.770	C1	O3	H7	106.770
O2	C1	O3	112.378	O2	C1	H4	112.281
O2	C1	H5	105.155	O3	C1	H4	105.155
O3	C1	H5	112.281	H4	C1	H5	109.718

All results from a given calculation for CH₂(OH)₂ (methanediol)

using model chemistry: CCSD/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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All results from a given calculation for CH2(OH)2 (methanediol)

using model chemistry: CCSD/6-31G*

States and conformations

All results from a given calculation for CH₂(OH)₂ (methanediol)