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	hartrees
Energy at 0K	-190.409021
Energy at 298.15K	-190.412181
HF Energy	-189.881337
Counterpoise corrected energy	-190.404929
CP Energy at 298.15K	-190.407580
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	68.417873

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3831	3686
2	A	3702	3561
3	A	3087	2970
4	A	2992	2878
5	A	1769	1702
6	A	1761	1694
7	A	1553	1494
8	A	1289	1240
9	A	1201	1155
10	A	570	548
11	A	325	312
12	A	224	215
13	A	194	187
14	A	149	143
15	A	144	139

Atom	x (Å)	y (Å)	z (Å)
H1	1.069	-0.484	-0.074
O2	1.835	0.119	-0.096
O3	-0.971	-0.689	-0.003
H4	2.331	-0.099	0.710
C5	-1.255	0.503	0.017
H6	-0.474	1.282	0.033
H7	-2.308	0.842	0.018

	H1	O2	O3	H4	C5	H6	H7
H1		0.9752	2.0507	1.5346	2.5266	2.3474	3.6289
O2	0.9752		2.9207	0.9707	3.1156	2.5881	4.2068
O3	2.0507	2.9207		3.4284	1.2257	2.0325	2.0324
H4	1.5346	0.9707	3.4284		3.7011	3.1979	4.7832
C5	2.5266	3.1156	1.2257	3.7011		1.1031	1.1060
H6	2.3474	2.5881	2.0325	3.1979	1.1031		1.8865
H7	3.6289	4.2068	2.0324	4.7832	1.1060	1.8865

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H4	104.117	H1	O3	C5	97.726
O2	H1	O3	147.513	O3	C5	H6	121.486
O3	C5	H7	121.220	H6	C5	H7	117.294

All results from a given calculation for H₂OH₂CO (water formaldehyde 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 H2OH2CO (water formaldehyde dimer)

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

States and conformations

All results from a given calculation for H₂OH₂CO (water formaldehyde dimer)