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	hartrees
Energy at 0K	-44.476498
Energy at 298.15K	-44.482271
HF Energy	-44.173754
Nuclear repulsion energy	67.701446

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3691	3567	12.29
2	A'	3131	3025	29.08
3	A'	3058	2955	48.33
4	A'	1547	1495	0.40
5	A'	1515	1464	4.82
6	A'	1450	1401	1.54
7	A'	1328	1284	10.05
8	A'	1229	1187	46.52
9	A'	1036	1001	33.56
10	A'	970	938	54.34
11	A'	722	698	73.24
12	A'	363	350	4.36
13	A'	238	230	15.26
14	A"	3232	3123	22.79
15	A"	3135	3029	57.74
16	A"	1312	1268	0.19
17	A"	1188	1148	1.07
18	A"	1062	1026	2.06
19	A"	831	803	0.79
20	A"	221	214	187.18
21	A"	112	108	33.83

Atom	x (Å)	y (Å)	z (Å)
C1	1.017	-0.545	0.000
C2	0.000	0.628	0.000
Cl3	-1.762	-0.072	0.000
O4	2.347	0.138	0.000
H5	0.899	-1.173	0.908
H6	0.899	-1.173	-0.908
H7	0.098	1.244	0.911
H8	0.098	1.244	-0.911
H9	3.084	-0.519	0.000

	C1	C2	Cl3	O4	H5	H6	H7	H8	H9
C1		1.5526	2.8186	1.4958	1.1104	1.1104	2.2074	2.2074	2.0676
C2	1.5526		1.8963	2.3978	2.2089	2.2089	1.1035	1.1035	3.2907
Cl3	2.8186	1.8963		4.1147	3.0195	3.0195	2.4541	2.4541	4.8667
O4	1.4958	2.3978	4.1147		2.1547	2.1547	2.6663	2.6663	0.9877
H5	1.1104	2.2089	3.0195	2.1547		1.8157	2.5465	3.1292	2.4550
H6	1.1104	2.2089	3.0195	2.1547	1.8157		3.1292	2.5465	2.4550
H7	2.2074	1.1035	2.4541	2.6663	2.5465	3.1292		1.8214	3.5852
H8	2.2074	1.1035	2.4541	2.6663	3.1292	2.5465	1.8214		3.5852
H9	2.0676	3.2907	4.8667	0.9877	2.4550	2.4550	3.5852	3.5852

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	109.216	C1	C2	H7	111.297
C1	C2	H8	111.297	C1	O4	H9	111.067
C2	C1	O4	103.721	C2	C1	H5	110.999
C2	C1	H6	110.999	Cl3	C2	H7	106.789
Cl3	C2	H8	106.789	O4	C1	H5	110.662
O4	C1	H6	110.662	H5	C1	H6	109.687
H7	C2	H8	111.229

All results from a given calculation for CH₂ClCH₂OH (2-Chloroethanol)

using model chemistry: MP2/CEP-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 CH2ClCH2OH (2-Chloroethanol)

using model chemistry: MP2/CEP-31G

States and conformations

All results from a given calculation for CH₂ClCH₂OH (2-Chloroethanol)