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	hartrees
Energy at 0K	-613.646564
Energy at 298.15K	-613.652521
HF Energy	-612.988792
Nuclear repulsion energy	158.986200

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3888	3688
2	A'	3160	2997
3	A'	3065	2907
4	A'	1582	1501
5	A'	1542	1463
6	A'	1495	1418
7	A'	1347	1278
8	A'	1259	1194
9	A'	1099	1042
10	A'	1053	999
11	A'	801	760
12	A'	395	375
13	A'	253	240
14	A"	3229	3063
15	A"	3111	2951
16	A"	1333	1265
17	A"	1237	1173
18	A"	1101	1045
19	A"	816	774
20	A"	237	224
21	A"	134	127

Atom	x (Å)	y (Å)	z (Å)
C1	0.969	-0.564	0.000
C2	0.000	0.606	0.000
Cl3	-1.692	0.014	0.000
O4	2.270	0.018	0.000
H5	0.797	-1.184	0.887
H6	0.797	-1.184	-0.887
H7	0.145	1.217	0.888
H8	0.145	1.217	-0.888
H9	2.913	-0.700	0.000

	C1	C2	Cl3	O4	H5	H6	H7	H8	H9
C1		1.5188	2.7231	1.4253	1.0961	1.0961	2.1542	2.1542	1.9492
C2	1.5188		1.7926	2.3448	2.1509	2.1509	1.0878	1.0878	3.1924
Cl3	2.7231	1.7926		3.9621	2.9018	2.9018	2.3688	2.3688	4.6604
O4	1.4253	2.3448	3.9621		2.0978	2.0978	2.5967	2.5967	0.9637
H5	1.0961	2.1509	2.9018	2.0978		1.7750	2.4885	3.0568	2.3452
H6	1.0961	2.1509	2.9018	2.0978	1.7750		3.0568	2.4885	2.3452
H7	2.1542	1.0878	2.3688	2.5967	2.4885	3.0568		1.7754	3.4824
H8	2.1542	1.0878	2.3688	2.5967	3.0568	2.4885	1.7754		3.4824
H9	1.9492	3.1924	4.6604	0.9637	2.3452	2.3452	3.4824	3.4824

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	110.365	C1	C2	H7	110.372
C1	C2	H8	110.372	C1	O4	H9	107.786
C2	C1	O4	105.543	C2	C1	H5	109.618
C2	C1	H6	109.618	Cl3	C2	H7	108.144
Cl3	C2	H8	108.144	O4	C1	H5	111.951
O4	C1	H6	111.951	H5	C1	H6	108.126
H7	C2	H8	109.382

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

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

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: CCSD(T)/6-31G**

States and conformations

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