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	hartrees
Energy at 0K	-190.469644
Energy at 298.15K	-190.472426
HF Energy	-189.909658
Counterpoise corrected energy	-190.467932
CP Energy at 298.15K	-190.470680
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	68.461367

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3962	3802
2	A	3796	3643
3	A	3124	2998
4	A	3030	2907
5	A	1758	1687
6	A	1656	1589
7	A	1556	1494
8	A	1288	1236
9	A	1200	1151
10	A	497	477
11	A	350	335
12	A	187	179
13	A	164	158
14	A	101	96
15	A	41	39

Atom	x (Å)	y (Å)	z (Å)
H1	-1.079	-0.458	-0.001
O2	-1.814	0.174	-0.001
O3	0.934	-0.690	-0.000
H4	-2.619	-0.353	0.004
C5	1.299	0.481	0.000
H6	0.575	1.306	0.001
H7	2.367	0.742	0.000

	H1	O2	O3	H4	C5	H6	H7
H1		0.9687	2.0264	1.5429	2.5575	2.4181	3.6491
O2	0.9687		2.8799	0.9625	3.1281	2.6429	4.2189
O3	2.0264	2.8799		3.5683	1.2270	2.0281	2.0258
H4	1.5429	0.9625	3.5683		4.0060	3.5988	5.1045
C5	2.5575	3.1281	1.2270	4.0060		1.0980	1.0988
H6	2.4181	2.6429	2.0281	3.5988	1.0980		1.8791
H7	3.6491	4.2189	2.0258	5.1045	1.0988	1.8791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H4	106.059	H1	O3	C5	100.765
O2	H1	O3	145.858	O3	C5	H6	121.353
O3	C5	H7	121.049	H6	C5	H7	117.597

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

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

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)/6-31+G**

States and conformations

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