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	hartrees
Energy at 0K	-189.159278
Energy at 298.15K	-189.164565
HF Energy	-188.845397
Nuclear repulsion energy	79.863416

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3628	3379	1.88
2	A	3121	2908	53.52
3	A	1634	1523	2.23
4	A	1461	1361	3.95
5	A	1256	1170	1.82
6	A	1013	943	115.33
7	A	576	537	149.40
8	A	405	377	27.66
9	B	3626	3378	3.49
10	B	3165	2948	59.24
11	B	1504	1401	55.18
12	B	1431	1333	28.70
13	B	1092	1017	147.45
14	B	1034	963	53.22
15	B	401	373	241.72

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.546
O2	0.000	1.198	-0.250
O3	0.000	-1.198	-0.250
H4	-0.888	-0.088	1.173
H5	0.888	0.088	1.173
H6	-0.809	1.194	-0.812
H7	0.809	-1.194	-0.812

	C1	O2	O3	H4	H5	H6	H7
C1		1.4384	1.4384	1.0909	1.0909	1.9808	1.9808
O2	1.4384		2.3962	2.1140	2.0116	0.9848	2.5868
O3	1.4384	2.3962		2.0116	2.1140	2.5868	0.9848
H4	1.0909	2.1140	2.0116		1.7850	2.3646	2.8361
H5	1.0909	2.0116	2.1140	1.7850		2.8361	2.3646
H6	1.9808	0.9848	2.5868	2.3646	2.8361		2.8839
H7	1.9808	2.5868	0.9848	2.8361	2.3646	2.8839

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	108.194	C1	O3	H7	108.194
O2	C1	O3	112.804	O2	C1	H4	112.674
O2	C1	H5	104.533	O3	C1	H4	104.533
O3	C1	H5	112.674	H4	C1	H5	109.793

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

using model chemistry: CID/3-21G

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: CID/3-21G

States and conformations

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