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	hartrees
Energy at 0K	-1710.192007
Energy at 298.15K	-1710.195345
HF Energy	-1710.192007
Nuclear repulsion energy	438.621774

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2271	2177	46.26
2	A₁	928	889	171.82
3	A₁	878	841	101.70
4	A₁	434	416	8.84
5	A₁	281	269	8.69
6	A₂	194	186	0.00
7	E	2290	2195	77.30
7	E	2290	2195	77.27
8	E	939	900	62.99
8	E	939	900	62.98
9	E	757	726	60.49
9	E	757	726	60.47
10	E	609	584	78.18
10	E	609	584	78.22
11	E	276	264	0.04
11	E	276	264	0.04
12	E	154	148	0.00
12	E	154	148	0.00

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.862
C2	0.000	0.000	-0.052
H3	0.000	-1.411	2.295
H4	1.222	0.706	2.295
H5	-1.222	0.706	2.295
Cl6	0.000	1.682	-0.640
Cl7	1.457	-0.841	-0.640
Cl8	-1.457	-0.841	-0.640

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9135	1.4763	1.4763	1.4763	3.0149	3.0149	3.0149
C2	1.9135		2.7385	2.7385	2.7385	1.7821	1.7821	1.7821
H3	1.4763	2.7385		2.4443	2.4443	4.2644	3.3262	3.3262
H4	1.4763	2.7385	2.4443		2.4443	3.3262	3.3262	4.2644
H5	1.4763	2.7385	2.4443	2.4443		3.3262	4.2644	3.3262
Cl6	3.0149	1.7821	4.2644	3.3262	3.3262		2.9135	2.9135
Cl7	3.0149	1.7821	3.3262	3.3262	4.2644	2.9135		2.9135
Cl8	3.0149	1.7821	3.3262	4.2644	3.3262	2.9135	2.9135

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.285	Si1	C2	Cl7	109.285
Si1	C2	Cl8	109.285	C2	Si1	H3	107.070
C2	Si1	H4	107.070	C2	Si1	H5	107.070
H3	Si1	H4	111.762	H3	Si1	H5	111.762
H4	Si1	H5	111.762	Cl6	C2	Cl7	109.657
Cl6	C2	Cl8	109.657	Cl7	C2	Cl8	109.657

All results from a given calculation for SiH₃CCl₃ ((trichloromethyl)silane)

using model chemistry: B1B95/6-311G*

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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Number	Element	Mulliken
1	Si	0.549
2	C	-0.606
3	H	-0.033
4	H	-0.033
5	H	-0.033
6	Cl	0.052
7	Cl	0.052
8	Cl	0.052

<r²>	272.005
(<r²>)^1/2	16.493

All results from a given calculation for SiH3CCl3 ((trichloromethyl)silane)

using model chemistry: B1B95/6-311G*

States and conformations

All results from a given calculation for SiH₃CCl₃ ((trichloromethyl)silane)