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	hartrees
Energy at 0K	-44.523420
Energy at 298.15K	-44.529189
HF Energy	-44.181853
Nuclear repulsion energy	67.997752

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3641	3553	13.16
2	A'	3076	3002	17.98
3	A'	2998	2926	35.67
4	A'	1547	1510	0.70
5	A'	1507	1470	3.93
6	A'	1451	1416	1.50
7	A'	1328	1297	11.32
8	A'	1221	1191	42.97
9	A'	1028	1004	34.12
10	A'	973	949	60.02
11	A'	718	701	73.90
12	A'	363	355	4.03
13	A'	236	231	15.12
14	A"	3178	3102	13.86
15	A"	3073	2999	39.10
16	A"	1304	1273	0.04
17	A"	1182	1154	0.62
18	A"	1062	1037	2.40
19	A"	817	797	0.01
20	A"	202	197	165.10
21	A"	111	108	41.29

Atom	x (Å)	y (Å)	z (Å)
C1	1.011	-0.532	0.000
C2	0.000	0.632	0.000
Cl3	-1.755	-0.082	0.000
O4	2.341	0.144	0.000
H5	0.891	-1.154	0.903
H6	0.891	-1.154	-0.903
H7	0.091	1.239	0.907
H8	0.091	1.239	-0.907
H9	3.070	-0.517	0.000

	C1	C2	Cl3	O4	H5	H6	H7	H8	H9
C1		1.5421	2.8025	1.4921	1.1027	1.1027	2.1926	2.1926	2.0589
C2	1.5421		1.8946	2.3918	2.1907	2.1907	1.0950	1.0950	3.2779
Cl3	2.8025	1.8946		4.1026	2.9942	2.9942	2.4442	2.4442	4.8445
O4	1.4921	2.3918	4.1026		2.1454	2.1454	2.6624	2.6624	0.9832
H5	1.1027	2.1907	2.9942	2.1454		1.8053	2.5236	3.1052	2.4433
H6	1.1027	2.1907	2.9942	2.1454	1.8053		3.1052	2.5236	2.4433
H7	2.1926	1.0950	2.4442	2.6624	2.5236	3.1052		1.8134	3.5751
H8	2.1926	1.0950	2.4442	2.6624	3.1052	2.5236	1.8134		3.5751
H9	2.0589	3.2779	4.8445	0.9832	2.4433	2.4433	3.5751	3.5751

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	108.833	C1	C2	H7	111.368
C1	C2	H8	111.368	C1	O4	H9	110.884
C2	C1	O4	104.039	C2	C1	H5	110.751
C2	C1	H6	110.751	Cl3	C2	H7	106.602
Cl3	C2	H8	106.602	O4	C1	H5	110.648
O4	C1	H6	110.648	H5	C1	H6	109.887
H7	C2	H8	111.795

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

using model chemistry: MP2/CEP-121G

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-121G

States and conformations

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