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	hartrees
Energy at 0K	-218.057951
Energy at 298.15K	-218.065766
HF Energy	-217.213000
Nuclear repulsion energy	132.698626

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3133	3133
2	A'	3127	3127
3	A'	3054	3054
4	A'	3046	3046
5	A'	1513	1513
6	A'	1495	1495
7	A'	1420	1420
8	A'	1379	1379
9	A'	1201	1201
10	A'	1160	1160
11	A'	967	967
12	A'	830	830
13	A'	473	473
14	A'	348	348
15	A'	254	254
16	A"	3131	3131
17	A"	3119	3119
18	A"	3043	3043
19	A"	1490	1490
20	A"	1485	1485
21	A"	1419	1419
22	A"	1378	1378
23	A"	1171	1171
24	A"	940	940
25	A"	927	927
26	A"	407	407
27	A"	206	206

Atom	x (Å)	y (Å)	z (Å)
C1	0.280	0.246	0.000
F2	-0.873	1.041	0.000
H3	1.127	0.938	0.000
C4	0.280	-0.585	1.267
C5	0.280	-0.585	-1.267
H6	1.192	-1.185	1.323
H7	1.192	-1.185	-1.323
H8	0.232	0.059	2.146
H9	0.232	0.059	-2.146
H10	-0.581	-1.256	1.275
H11	-0.581	-1.256	-1.275

	C1	F2	H3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.4013	1.0936	1.5156	1.5156	2.1513	2.1513	2.1543	2.1543	2.1502	2.1502
F2	1.4013		2.0029	2.3628	2.3628	3.3121	3.3121	2.6057	2.6057	2.6436	2.6436
H3	1.0936	2.0029		2.1550	2.1550	2.5024	2.5024	2.4855	2.4855	3.0590	3.0590
C4	1.5156	2.3628	2.1550		2.5346	1.0920	2.8109	1.0904	3.4735	1.0918	2.7667
C5	1.5156	2.3628	2.1550	2.5346		2.8109	1.0920	3.4735	1.0904	2.7667	1.0918
H6	2.1513	3.3121	2.5024	1.0920	2.8109		2.6467	1.7731	3.8081	1.7747	3.1461
H7	2.1513	3.3121	2.5024	2.8109	1.0920	2.6467		3.8081	1.7731	3.1461	1.7747
H8	2.1543	2.6057	2.4855	1.0904	3.4735	1.7731	3.8081		4.2912	1.7744	3.7537
H9	2.1543	2.6057	2.4855	3.4735	1.0904	3.8081	1.7731	4.2912		3.7537	1.7744
H10	2.1502	2.6436	3.0590	1.0918	2.7667	1.7747	3.1461	1.7744	3.7537		2.5498
H11	2.1502	2.6436	3.0590	2.7667	1.0918	3.1461	1.7747	3.7537	1.7744	2.5498

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H8	110.450	C1	C4	H10	110.046
C1	C5	H7	110.115	C1	C5	H9	110.450
C1	C5	H11	110.046	F2	C1	H3	106.143
F2	C1	C4	108.137	F2	C1	C5	108.137
H3	C1	C4	110.317	H3	C1	C5	110.317
C4	C1	C5	113.477	H7	C5	H9	108.673
H7	C5	H11	108.713	H8	C4	H10	108.801
H9	C5	H11	108.801

All results from a given calculation for CH₃CHFCH₃ (2-Fluoropropane)

using model chemistry: QCISD(T)/Def2TZVPP

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 CH3CHFCH3 (2-Fluoropropane)

using model chemistry: QCISD(T)/Def2TZVPP

States and conformations

All results from a given calculation for CH₃CHFCH₃ (2-Fluoropropane)