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	hartrees
Energy at 0K	-253.793090
Energy at 298.15K
HF Energy	-253.038762
Nuclear repulsion energy	132.027491

Atom	x (Å)	y (Å)	z (Å)
C1	0.676	0.569	0.282
C2	-0.716	0.547	-0.279
O3	1.448	-0.500	-0.190
F4	-1.352	-0.596	0.156
H5	1.169	1.480	-0.034
H6	0.628	0.570	1.367
H7	-1.289	1.400	0.063
H8	-0.699	0.520	-1.360
H9	1.022	-1.311	0.060

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5014	1.3999	2.3427	1.0824	1.0865	2.1450	2.1425	1.9242
C2	1.5014		2.4055	1.3783	2.1174	2.1252	1.0827	1.0818	2.5666
O3	1.3999	2.4055		2.8226	2.0052	2.0589	3.3410	2.6493	0.9494
F4	2.3427	1.3783	2.8226		3.2711	2.5974	1.9988	1.9923	2.4811
H5	1.0824	2.1174	2.0052	3.2711		1.7563	2.4612	2.4838	2.7961
H6	1.0865	2.1252	2.0589	2.5974	1.7563		2.4628	3.0334	2.3235
H7	2.1450	1.0827	3.3410	1.9988	2.4612	2.4628		1.7742	3.5620
H8	2.1425	1.0818	2.6493	1.9923	2.4838	3.0334	1.7742		2.8863
H9	1.9242	2.5666	0.9494	2.4811	2.7961	2.3235	3.5620	2.8863

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.810	C1	C2	H7	111.187
C1	C2	H8	111.032	C1	O3	H9	108.456
C2	C1	O3	111.968	C2	C1	H5	108.994
C2	C1	H6	109.368	O3	C1	H5	107.072
O3	C1	H6	111.172

All results from a given calculation for CH₂FCH₂OH (2-fluoroethanol)

using model chemistry: CID/daug-cc-pVTZ

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 CH2FCH2OH (2-fluoroethanol)

using model chemistry: CID/daug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂FCH₂OH (2-fluoroethanol)