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	hartrees
Energy at 0K	-190.457309
Energy at 298.15K	-190.462606
HF Energy	-189.923730
Nuclear repulsion energy	81.292054

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3864	3629	31.78
2	A	3151	2959	51.70
3	A	1583	1487	1.16
4	A	1408	1322	2.83
5	A	1219	1145	2.14
6	A	1055	991	110.76
7	A	578	543	106.46
8	A	421	396	41.94
9	B	3864	3629	53.59
10	B	3224	3028	37.05
11	B	1479	1389	64.30
12	B	1379	1295	23.93
13	B	1096	1029	281.97
14	B	1023	961	13.81
15	B	400	376	218.77

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.535
O2	0.000	1.174	-0.248
O3	0.000	-1.174	-0.248
H4	-0.891	-0.077	1.155
H5	0.891	0.077	1.155
H6	-0.807	1.171	-0.780
H7	0.807	-1.171	-0.780

	C1	O2	O3	H4	H5	H6	H7
C1		1.4108	1.4108	1.0881	1.0881	1.9371	1.9371
O2	1.4108		2.3471	2.0797	1.9911	0.9667	2.5359
O3	1.4108	2.3471		1.9911	2.0797	2.5359	0.9667
H4	1.0881	2.0797	1.9911		1.7887	2.3040	2.7973
H5	1.0881	1.9911	2.0797	1.7887		2.7973	2.3040
H6	1.9371	0.9667	2.5359	2.3040	2.7973		2.8438
H7	1.9371	2.5359	0.9667	2.7973	2.3040	2.8438

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H6	107.656	C1	O3	H7	107.656
O2	C1	O3	112.576	O2	C1	H4	112.012
O2	C1	H5	104.915	O3	C1	H4	104.915
O3	C1	H5	112.012	H4	C1	H5	110.566

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

using model chemistry: MP2=FULL/6-31+G**

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/6-31+G**

States and conformations

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