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	hartrees
Energy at 0K	-190.430108
Energy at 298.15K	-190.435405
HF Energy	-189.897615
Nuclear repulsion energy	81.166538

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3729	3585
2	A	3062	2944
3	A	1579	1518
4	A	1426	1371
5	A	1231	1184
6	A	1059	1018
7	A	580	558
8	A	410	394
9	B	3728	3585
10	B	3119	2999
11	B	1480	1424
12	B	1404	1350
13	B	1116	1073
14	B	1033	993
15	B	416	400

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.536
O2	0.000	1.173	-0.248
O3	0.000	-1.173	-0.248
H4	-0.895	-0.080	1.168
H5	0.895	0.080	1.168
H6	-0.808	1.141	-0.793
H7	0.808	-1.141	-0.793

	C1	O2	O3	H4	H5	H6	H7
C1		1.4112	1.4112	1.0983	1.0983	1.9284	1.9284
O2	1.4112		2.3465	2.0921	1.9999	0.9745	2.5105
O3	1.4112	2.3465		1.9999	2.0921	2.5105	0.9745
H4	1.0983	2.0921	1.9999		1.7971	2.3111	2.8045
H5	1.0983	1.9999	2.0921	1.7971		2.8045	2.3111
H6	1.9284	0.9745	2.5105	2.3111	2.8045		2.7951
H7	1.9284	2.5105	0.9745	2.8045	2.3111	2.7951

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	106.420	C1	O3	H7	106.420
O2	C1	O3	112.482	O2	C1	H4	112.359
O2	C1	H5	104.992	O3	C1	H4	104.992
O3	C1	H5	112.359	H4	C1	H5	109.796

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

using model chemistry: MP4=FULL/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: MP4=FULL/6-31G*

States and conformations

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