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	hartrees
Energy at 0K	-214.695091
Energy at 298.15K
HF Energy	-213.997803
Nuclear repulsion energy	79.313686

Atom	x (Å)	y (Å)	z (Å)
C1	0.019	0.512	0.047
F2	1.126	-0.312	-0.025
O3	-1.140	-0.217	-0.119
H4	0.067	1.011	1.016
H5	0.077	1.221	-0.775
H6	-1.279	-0.760	0.661

	C1	F2	O3	H4	H5	H6
C1		1.3823	1.3786	1.0914	1.0870	1.9177
F2	1.3823		2.2701	1.9895	2.0032	2.5407
O3	1.3786	2.2701		2.0622	1.9943	0.9604
H4	1.0914	1.9895	2.0622		1.8034	2.2526
H5	1.0870	2.0032	1.9943	1.8034		2.7969
H6	1.9177	2.5407	0.9604	2.2526	2.7969

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.825	F2	C1	O3	110.618
F2	C1	H4	106.488	F2	C1	H5	107.841
O3	C1	H4	112.687	O3	C1	H5	107.377
H4	C1	H5	111.758

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: QCISD/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 CH2FOH (fluoromethanol)

using model chemistry: QCISD/daug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)