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	hartrees
Energy at 0K	-190.689376
Energy at 298.15K	-190.694603
HF Energy	-189.988057
Nuclear repulsion energy	81.527213

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3833	3636
2	A	3049	2893
3	A	1544	1465
4	A	1411	1339
5	A	1222	1159
6	A	1051	997
7	A	565	536
8	A	373	354
9	B	3832	3635
10	B	3100	2940
11	B	1461	1386
12	B	1388	1317
13	B	1105	1048
14	B	1020	967
15	B	374	355

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.531
O2	0.000	1.171	-0.247
O3	0.000	-1.171	-0.247
H4	-0.890	-0.073	1.159
H5	0.890	0.073	1.159
H6	-0.807	1.157	-0.772
H7	0.807	-1.157	-0.772

	C1	O2	O3	H4	H5	H6	H7
C1		1.4059	1.4059	1.0919	1.0919	1.9198	1.9198
O2	1.4059		2.3418	2.0780	1.9936	0.9624	2.5187
O3	1.4059	2.3418		1.9936	2.0780	2.5187	0.9624
H4	1.0919	2.0780	1.9936		1.7863	2.2908	2.7894
H5	1.0919	1.9936	2.0780	1.7863		2.7894	2.2908
H6	1.9198	0.9624	2.5187	2.2908	2.7894		2.8207
H7	1.9198	2.5187	0.9624	2.7894	2.2908	2.8207

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	106.821	C1	O3	H7	106.821
O2	C1	O3	112.788	O2	C1	H4	111.986
O2	C1	H5	105.214	O3	C1	H4	105.214
O3	C1	H5	111.986	H4	C1	H5	109.761

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

using model chemistry: QCISD(T)/cc-pVTZ

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: QCISD(T)/cc-pVTZ

States and conformations

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