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	hartrees
Energy at 0K	-189.178170
Energy at 298.15K	-189.183437
HF Energy	-188.843679
Nuclear repulsion energy	79.327288

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3523	3363	1.68
2	A	3098	2958	56.35
3	A	1623	1549	2.52
4	A	1438	1373	2.66
5	A	1238	1182	2.73
6	A	974	930	110.02
7	A	570	545	141.74
8	A	397	379	21.76
9	B	3524	3364	3.91
10	B	3151	3008	60.56
11	B	1488	1420	48.05
12	B	1407	1343	21.94
13	B	1042	995	112.70
14	B	1022	976	87.86
15	B	412	393	236.89

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.547
O2	0.000	1.210	-0.251
O3	0.000	-1.210	-0.251
H4	-0.890	-0.096	1.174
H5	0.890	0.096	1.174
H6	-0.820	1.190	-0.810
H7	0.820	-1.190	-0.810

	C1	O2	O3	H4	H5	H6	H7
C1		1.4495	1.4495	1.0926	1.0926	1.9828	1.9828
O2	1.4495		2.4196	2.1276	2.0159	0.9927	2.5969
O3	1.4495	2.4196		2.0159	2.1276	2.5969	0.9927
H4	1.0926	2.1276	2.0159		1.7901	2.3653	2.8388
H5	1.0926	2.0159	2.1276	1.7901		2.8388	2.3653
H6	1.9828	0.9927	2.5969	2.3653	2.8388		2.8901
H7	1.9828	2.5969	0.9927	2.8388	2.3653	2.8901

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	107.073	C1	O3	H7	107.073
O2	C1	O3	113.163	O2	C1	H4	112.885
O2	C1	H5	104.055	O3	C1	H4	104.055
O3	C1	H5	112.885	H4	C1	H5	110.007

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

using model chemistry: MP2=FULL/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: MP2=FULL/3-21G

States and conformations

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