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	hartrees
Energy at 0K	-190.548657
Energy at 298.15K	-190.553849
HF Energy	-189.943116
Nuclear repulsion energy	80.730717

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3783	3689
2	A	3059	2984
3	A	1512	1475
4	A	1385	1350
5	A	1198	1168
6	A	1022	996
7	A	546	533
8	A	372	362
9	B	3784	3690
10	B	3121	3044
11	B	1436	1400
12	B	1359	1325
13	B	1059	1033
14	B	1002	977
15	B	373	364

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.538
O2	0.000	1.182	-0.250
O3	0.000	-1.182	-0.250
H4	-0.903	-0.076	1.167
H5	0.903	0.076	1.167
H6	-0.811	1.172	-0.780
H7	0.811	-1.172	-0.780

	C1	O2	O3	H4	H5	H6	H7
C1		1.4206	1.4206	1.1032	1.1032	1.9411	1.9411
O2	1.4206		2.3641	2.0995	2.0116	0.9690	2.5456
O3	1.4206	2.3641		2.0116	2.0995	2.5456	0.9690
H4	1.1032	2.0995	2.0116		1.8119	2.3147	2.8160
H5	1.1032	2.0116	2.0995	1.8119		2.8160	2.3147
H6	1.9411	0.9690	2.5456	2.3147	2.8160		2.8508
H7	1.9411	2.5456	0.9690	2.8160	2.3147	2.8508

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	107.127	C1	O3	H7	107.127
O2	C1	O3	112.625	O2	C1	H4	111.971
O2	C1	H5	105.004	O3	C1	H4	105.004
O3	C1	H5	111.971	H4	C1	H5	110.409

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

using model chemistry: MP4=FULL/aug-cc-pVDZ

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: MP4=FULL/aug-cc-pVDZ

States and conformations

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