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	hartrees
Energy at 0K
Energy at 298.15K	-0.189099
HF Energy	-0.189099
Nuclear repulsion energy	113.043521

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3169	3021	4.02	130.26	0.04	0.08
2	A'	3080	2937	13.20	86.99	0.75	0.86
3	A'	2988	2849	0.16	185.73	0.37	0.54
4	A'	1468	1400	65.21	7.43	0.74	0.85
5	A'	1413	1348	8.93	3.08	0.72	0.83
6	A'	1377	1313	5.31	34.40	0.75	0.86
7	A'	1281	1222	13.73	27.06	0.74	0.85
8	A'	1155	1101	16.24	20.72	0.56	0.71
9	A'	1009	962	2.00	9.23	0.46	0.63
10	A'	574	547	11.95	0.84	0.30	0.46
11	A'	465	443	11.95	2.86	0.73	0.85
12	A"	3086	2942	9.98	99.57	0.75	0.86
13	A"	1494	1425	102.12	1.91	0.75	0.86
14	A"	1386	1321	8.65	40.47	0.75	0.86
15	A"	1271	1212	3.00	21.68	0.75	0.86
16	A"	1022	974	0.01	12.73	0.75	0.86
17	A"	414	395	0.05	1.03	0.75	0.86
18	A"	118	113	0.03	0.01	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.320	0.171	0.000
C2	-0.897	1.105	0.000
H3	1.278	0.775	0.000
F4	0.320	-0.691	1.076
F5	0.320	-0.691	-1.076
H6	-1.840	0.510	0.000
H7	-0.867	1.745	0.912
H8	-0.867	1.745	-0.912

	C1	C2	H3	F4	F5	H6	H7	H8
C1		1.5336	1.1323	1.3787	1.3787	2.1865	2.1716	2.1716
C2	1.5336		2.1993	2.4212	2.4212	1.1151	1.1143	1.1143
H3	1.1323	2.1993		2.0553	2.0553	3.1291	2.5238	2.5238
F4	1.3787	2.4212	2.0553		2.1518	2.6955	2.7144	3.3602
F5	1.3787	2.4212	2.0553	2.1518		2.6955	3.3602	2.7144
H6	2.1865	1.1151	3.1291	2.6955	2.6955		1.8175	1.8175
H7	2.1716	1.1143	2.5238	2.7144	3.3602	1.8175		1.8231
H8	2.1716	1.1143	2.5238	3.3602	2.7144	1.8175	1.8231

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	110.280	C1	C2	H7	109.166
C1	C2	H8	109.166	C2	C1	H3	110.265
C2	C1	F4	112.372	C2	C1	F5	112.372
H3	C1	F4	109.486	H3	C1	F5	109.486
F4	C1	F5	102.593	H6	C2	H7	109.221
H6	C2	H8	109.221	H7	C2	H8	109.776

All results from a given calculation for CH₃CHF₂ (Ethane, 1,1-difluoro-)

using model chemistry: AM1

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 CH3CHF2 (Ethane, 1,1-difluoro-)

using model chemistry: AM1

States and conformations

All results from a given calculation for CH₃CHF₂ (Ethane, 1,1-difluoro-)