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	hartrees
Energy at 0K	-152.556245
Energy at 298.15K	-152.558988
HF Energy	-152.087402
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	36.393320

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3876	3731
2	A'	3782	3640
3	A'	3713	3574
4	A'	1658	1596
5	A'	1639	1578
6	A'	355	342
7	A'	183	176
8	A'	147	141
9	A"	3896	3750
10	A"	630	606
11	A"	145	140
12	A"	131	126

Atom	x (Å)	y (Å)	z (Å)
H1	0.098	0.558	0.000
O2	0.001	1.525	0.000
O3	0.001	-1.400	0.000
H4	0.907	1.857	0.000
H5	-0.507	-1.709	0.763
H6	-0.507	-1.709	-0.763

	H1	O2	O3	H4	H5	H6
H1		0.9723	1.9603	1.5303	2.4670	2.4670
O2	0.9723		2.9252	0.9656	3.3612	3.3612
O3	1.9603	2.9252		3.3808	0.9671	0.9671
H4	1.5303	0.9656	3.3808		3.9109	3.9109
H5	2.4670	3.3612	0.9671	3.9109		1.5266
H6	2.4670	3.3612	0.9671	3.9109	1.5266

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H4	104.305	H1	O3	H5	110.175
H1	O3	H6	110.175	O2	H1	O3	171.352
H5	O3	H6	104.225

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

using model chemistry: CCSD(T)/aug-cc-pVDZ

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: CCSD(T)/aug-cc-pVDZ

States and conformations

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