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	hartrees
Energy at 0K	-191.551287
Energy at 298.15K	-191.543328
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3762	3548	10.91
2	A'	3697	3486	372.68
3	A'	3203	3020	44.19
4	A'	3062	2888	62.11
5	A'	1730	1631	92.70
6	A'	1581	1491	1.95
7	A'	1540	1453	8.53
8	A'	1488	1403	50.96
9	A'	1149	1084	12.81
10	A'	1110	1047	96.10
11	A'	311	293	281.77
12	A'	187	176	6.65
13	A'	68	64	52.50
14	A"	3895	3673	68.41
15	A"	3124	2946	78.74
16	A"	1566	1476	0.87
17	A"	1207	1138	0.96
18	A"	740	698	153.00
19	A"	220	207	5.52
20	A"	103	97	35.08
21	A"	61	57	51.17

Atom	x (Å)	y (Å)	z (Å)
H1	0.000	0.394	0.000
O2	-0.972	0.362	0.000
O3	1.983	0.577	0.000
C4	-1.358	-0.998	0.000
H5	2.266	1.092	0.769
H6	2.266	1.092	-0.769
H7	-2.450	-1.020	0.000
H8	-1.008	-1.542	-0.889
H9	-1.008	-1.542	0.889

	H1	O2	O3	C4	H5	H6	H7	H8	H9
H1		0.9725	1.9909	1.9453	2.4926	2.4926	2.8289	2.3573	2.3573
O2	0.9725		2.9623	1.4137	3.4073	3.4073	2.0233	2.1018	2.1018
O3	1.9909	2.9623		3.6937	0.9677	0.9677	4.7115	3.7715	3.7715
C4	1.9453	1.4137	3.6937		4.2541	4.2541	1.0919	1.0997	1.0997
H5	2.4926	3.4073	0.9677	4.2541		1.5372	5.2244	4.5174	4.2041
H6	2.4926	3.4073	0.9677	4.2541	1.5372		5.2244	4.2041	4.5174
H7	2.8289	2.0233	4.7115	1.0919	5.2244	5.2244		1.7730	1.7730
H8	2.3573	2.1018	3.7715	1.0997	4.5174	4.2041	1.7730		1.7774
H9	2.3573	2.1018	3.7715	1.0997	4.2041	4.5174	1.7730	1.7774

All results from a given calculation for CH₃OHH₂O (methanol water dimer)

using model chemistry: MP2_cp/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 CH3OHH2O (methanol water dimer)

using model chemistry: MP2_cp/6-31G*

States and conformations

All results from a given calculation for CH₃OHH₂O (methanol water dimer)