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	hartrees
Energy at 0K	-151.423070
Energy at 298.15K	-151.416756
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3632	3467	49.25
2	A'	3520	3360	2.03
3	A'	3441	3284	248.18
4	A'	1788	1707	59.37
5	A'	1720	1642	68.46
6	A'	532	508	58.12
7	A'	281	268	221.11
8	A'	218	208	243.19
9	A"	3667	3500	13.68
10	A"	850	811	192.84
11	A"	224	214	58.46
12	A"	138	132	180.95

Atom	x (Å)	y (Å)	z (Å)
H1	0.168	0.505	0.000
O2	0.004	1.482	0.000
O3	0.004	-1.395	0.000
H4	0.888	1.921	0.000
H5	-0.559	-1.559	0.798
H6	-0.559	-1.559	-0.798

	H1	O2	O3	H4	H5	H6
H1		0.9905	1.9075	1.5883	2.3292	2.3292
O2	0.9905		2.8773	0.9868	3.1936	3.1936
O3	1.9075	2.8773		3.4321	0.9907	0.9907
H4	1.5883	0.9868	3.4321		3.8521	3.8521
H5	2.3292	3.1936	0.9907	3.8521		1.5969
H6	2.3292	3.1936	0.9907	3.8521	1.5969

All results from a given calculation for H₂OH₂O (water dimer)

using model chemistry: MP2_cp/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 H2OH2O (water dimer)

using model chemistry: MP2_cp/3-21G

States and conformations

All results from a given calculation for H₂OH₂O (water dimer)