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	hartrees
Energy at 0K	-230.805890
Energy at 298.15K
Counterpoise corrected energy
CP Energy at 298.15K
Counterpoise optimized geometry corrected energy
CP opt. Energy at 298.15K
Nuclear repulsion energy	134.187249

Atom	x (Å)	y (Å)	z (Å)
H1	-1.405	-0.001	-0.128
O2	-2.332	-0.002	0.170
O3	0.434	-0.000	-0.421
C4	1.035	-1.179	0.112
C5	1.031	1.180	0.112
H6	-2.862	0.003	-0.634
H7	0.919	-1.214	1.198
H8	0.521	-2.024	-0.337
H9	2.097	-1.213	-0.143
H10	0.515	2.024	-0.336
H11	0.916	1.214	1.198
H12	2.093	1.218	-0.144

	H1	O2	O3	C4	C5	H6	H7	H8	H9	H10	H11	H12
H1		0.9737	1.8617	2.7193	2.7177	1.5429	2.9369	2.8011	3.7055	2.7979	2.9359	3.7043
O2	0.9737		2.8280	3.5669	3.5652	0.9627	3.6184	3.5339	4.6023	3.5303	3.6172	4.6009
O3	1.8617	2.8280		1.4265	1.4264	3.3025	2.0811	2.0277	2.0775	2.0275	2.0812	2.0774
C4	2.7193	3.5669	1.4265		2.3591	4.1397	1.0933	1.0860	1.0930	3.2755	2.6312	2.6330
C5	2.7177	3.5652	1.4264	2.3591		4.1350	2.6312	3.2756	2.6325	1.0860	1.0933	1.0930
H6	1.5429	0.9627	3.3025	4.1397	4.1350		4.3739	3.9555	5.1296	3.9465	4.3699	5.1255
H7	2.9369	3.6184	2.0811	1.0933	2.6312	4.3739		1.7811	1.7855	3.6055	2.4280	3.0158
H8	2.8011	3.5339	2.0277	1.0860	3.2756	3.9555	1.7811		1.7826	4.0481	3.6058	3.6086
H9	3.7055	4.6023	2.0775	1.0930	2.6325	5.1296	1.7855	1.7826		3.6084	3.0149	2.4318
H10	2.7979	3.5303	2.0275	3.2755	1.0860	3.9465	3.6055	4.0481	3.6084		1.7809	1.7825
H11	2.9359	3.6172	2.0812	2.6312	1.0933	4.3699	2.4280	3.6058	3.0149	1.7809		1.7855
H12	3.7043	4.6009	2.0774	2.6330	1.0930	5.1255	3.0158	3.6086	2.4318	1.7825	1.7855

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	O2	H6	105.642	H1	O3	C4	110.890
H1	O3	C5	110.796	O2	H1	O3	171.313
O3	C4	H7	110.668	O3	C4	H8	106.839
O3	C4	H9	110.387	O3	C5	H10	106.825
O3	C5	H11	110.684	O3	C5	H12	110.392
C4	O3	C5	111.572	H7	C4	H8	109.626
H7	C4	H9	109.502	H8	C4	H9	109.780
H10	C5	H11	109.614	H10	C5	H12	109.777
H11	C5	H12	109.511

Number	Element	Mulliken
1	H	0.440
2	O	-0.786
3	O	-0.494
4	C	-0.123
5	C	-0.120
6	H	0.356
7	H	0.101
8	H	0.149
9	H	0.119
10	H	0.135
11	H	0.114
12	H	0.109

All results from a given calculation for H₂OCH₃OCH₃ (water dimethylether dimer)

using model chemistry: MP2/6-31+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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	x	y	z	Total
	-3.067	-0.002	-1.173	3.284
CHELPG
AIM
ESP

	x	y	z
x	5.607	0.159	-0.081
y	0.159	5.511	-0.074
z	-0.081	-0.074	4.813

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for H2OCH3OCH3 (water dimethylether dimer)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for H₂OCH₃OCH₃ (water dimethylether dimer)