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	hartrees
Energy at 0K	-152.473949
Energy at 298.15K	-152.476726
HF Energy	-152.054213
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	36.588503

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3972	3767
2	A'	3861	3662
3	A'	3825	3628
4	A'	1724	1636
5	A'	1692	1605
6	A'	419	397
7	A'	201	190
8	A'	142	134
9	A"	3980	3775
10	A"	644	611
11	A"	166	157
12	A"	88	84

Atom	x (Å)	y (Å)	z (Å)
H1	0.164	0.550	0.000
O2	0.006	1.504	0.000
O3	0.006	-1.426	0.000
H4	0.888	1.887	0.000
H5	-0.577	-1.528	0.760
H6	-0.577	-1.528	-0.760

	H1	O2	O3	H4	H5	H6
H1		0.9666	1.9829	1.5201	2.3337	2.3337
O2	0.9666		2.9303	0.9612	3.1798	3.1798
O3	1.9829	2.9303		3.4285	0.9637	0.9637
H4	1.5201	0.9612	3.4285		3.7928	3.7928
H5	2.3337	3.1798	0.9637	3.7928		1.5200
H6	2.3337	3.1798	0.9637	3.7928	1.5200

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H4	104.093	H1	O3	H5	98.812
H1	O3	H6	98.812	O2	H1	O3	166.061
H5	O3	H6	104.112

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

using model chemistry: CCSD(T)/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 H2OH2O (water dimer)

using model chemistry: CCSD(T)/6-31G**

States and conformations

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