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	hartrees
Energy at 0K	-190.433317
Energy at 298.15K	-190.436121
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3987	3750	125.51
2	A	3804	3578	123.45
3	A	3165	2977	61.77
4	A	3065	2883	47.61
5	A	1751	1647	51.35
6	A	1643	1546	113.00
7	A	1568	1475	18.96
8	A	1292	1215	6.57
9	A	1221	1148	6.85
10	A	483	454	137.99
11	A	342	322	142.75
12	A	173	163	31.25
13	A	165	155	0.31
14	A	90	85	51.25
15	A	83	78	194.88

Atom	x (Å)	y (Å)	z (Å)
H1	1.116	-0.452	-0.000
O2	1.855	0.175	-0.000
O3	-0.952	-0.689	-0.000
H4	2.657	-0.357	0.000
C5	-1.330	0.480	0.000
H6	-0.615	1.311	0.000
H7	-2.398	0.730	-0.000

	H1	O2	O3	H4	C5	H6	H7
H1		0.9686	2.0821	1.5435	2.6176	2.4713	3.7073
O2	0.9686		2.9368	0.9622	3.1990	2.7187	4.2883
O3	2.0821	2.9368		3.6245	1.2280	2.0279	2.0249
H4	1.5435	0.9622	3.6245		4.0734	3.6725	5.1698
C5	2.6176	3.1990	1.2280	4.0734		1.0960	1.0967
H6	2.4713	2.7187	2.0279	3.6725	1.0960		1.8747
H7	3.7073	4.2883	2.0249	5.1698	1.0967	1.8747

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H4	106.149	H1	O3	C5	101.378
O2	H1	O3	146.183	O3	C5	H6	121.417
O3	C5	H7	121.059	H6	C5	H7	117.525

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

using model chemistry: MP2_cp_opt/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: MP2_cp_opt/6-31+G**

States and conformations

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