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	hartrees
Energy at 0K	-176.239455
Energy at 298.15K
HF Energy	-175.918203
Nuclear repulsion energy	66.265373

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3255	3128	5.01
2	A'	3199	3075	10.59
3	A'	3164	3041	1.04
4	A'	1712	1646	52.01
5	A'	1495	1437	3.02
6	A'	1382	1328	0.37
7	A'	1186	1140	42.32
8	A'	957	919	23.94
9	A'	478	459	4.29
10	A"	991	953	31.42
11	A"	923	887	57.59
12	A"	727	699	0.08

Atom	x (Å)	y (Å)
C1	0.000	0.441
C2	1.211	-0.116
F3	-1.169	-0.309
H4	-0.187	1.511
H5	1.344	-1.194
H6	2.098	0.512

	C1	C2	F3	H4	H5	H6
C1		1.3331	1.3888	1.0863	2.1161	2.0988
C2	1.3331		2.3883	2.1450	1.0864	1.0859
F3	1.3888	2.3883		2.0678	2.6642	3.3682
H4	1.0863	2.1450	2.0678		3.1080	2.4934
H5	2.1161	1.0864	2.6642	3.1080		1.8650
H6	2.0988	1.0859	3.3682	2.4934	1.8650

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	121.671	C1	C2	H6	120.022
C2	C1	F3	122.662	C2	C1	H4	124.583
F3	C1	H4	112.754	H5	C2	H6	118.308

All results from a given calculation for CH₂CHF (Ethene, fluoro-)

using model chemistry: QCISD/3-21G*

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 CH2CHF (Ethene, fluoro-)

using model chemistry: QCISD/3-21G*

States and conformations

All results from a given calculation for CH₂CHF (Ethene, fluoro-)