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	hartrees
Energy at 0K	-190.708515
Energy at 298.15K	-190.713709
HF Energy	-189.992260
Nuclear repulsion energy	81.364757

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3810	3684
2	A	3050	2949
3	A	1540	1489
4	A	1398	1351
5	A	1210	1170
6	A	1043	1008
7	A	556	538
8	A	370	358
9	B	3810	3683
10	B	3104	3000
11	B	1450	1402
12	B	1376	1331
13	B	1084	1048
14	B	1011	977
15	B	358	346

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.533
O2	0.000	1.172	-0.249
O3	0.000	-1.172	-0.249
H4	-0.893	-0.071	1.158
H5	0.893	0.071	1.158
H6	-0.812	1.172	-0.768
H7	0.812	-1.172	-0.768

	C1	O2	O3	H4	H5	H6	H7
C1		1.4089	1.4089	1.0923	1.0923	1.9305	1.9305
O2	1.4089		2.3441	2.0789	1.9972	0.9640	2.5346
O3	1.4089	2.3441		1.9972	2.0789	2.5346	0.9640
H4	1.0923	2.0789	1.9972		1.7916	2.2942	2.7983
H5	1.0923	1.9972	2.0789	1.7916		2.7983	2.2942
H6	1.9305	0.9640	2.5346	2.2942	2.7983		2.8516
H7	1.9305	2.5346	0.9640	2.7983	2.2942	2.8516

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	107.406	C1	O3	H7	107.406
O2	C1	O3	112.594	O2	C1	H4	111.818
O2	C1	H5	105.271	O3	C1	H4	105.271
O3	C1	H5	111.818	H4	C1	H5	110.190

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

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

States and conformations

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