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	hartrees
Energy at 0K	-1707.731376
Energy at 298.15K	-1707.734853
HF Energy	-1707.026733
Nuclear repulsion energy	434.431176

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2276	2178	43.85
2	A₁	944	903	209.76
3	A₁	894	856	71.08
4	A₁	436	417	7.99
5	A₁	287	274	9.88
6	A₂	198	189	0.00
7	E	2296	2197	78.68
7	E	2296	2197	78.68
8	E	952	911	64.38
8	E	952	911	64.38
9	E	803	768	38.80
9	E	803	768	38.81
10	E	623	596	55.39
10	E	623	596	55.40
11	E	277	265	0.01
11	E	277	265	0.01
12	E	167	160	0.04
12	E	167	160	0.04

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.890
C2	0.000	0.000	-0.049
H3	0.000	-1.416	2.336
H4	1.226	0.708	2.336
H5	-1.226	0.708	2.336
Cl6	0.000	1.694	-0.650
Cl7	1.467	-0.847	-0.650
Cl8	-1.467	-0.847	-0.650

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9387	1.4848	1.4848	1.4848	3.0533	3.0533	3.0533
C2	1.9387		2.7739	2.7739	2.7739	1.7976	1.7976	1.7976
H3	1.4848	2.7739		2.4528	2.4528	4.3120	3.3760	3.3760
H4	1.4848	2.7739	2.4528		2.4528	3.3760	3.3760	4.3120
H5	1.4848	2.7739	2.4528	2.4528		3.3760	4.3120	3.3760
Cl6	3.0533	1.7976	4.3120	3.3760	3.3760		2.9339	2.9339
Cl7	3.0533	1.7976	3.3760	3.3760	4.3120	2.9339		2.9339
Cl8	3.0533	1.7976	3.3760	4.3120	3.3760	2.9339	2.9339

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.556	Si1	C2	Cl7	109.556
Si1	C2	Cl8	109.556	C2	Si1	H3	107.499
C2	Si1	H4	107.499	C2	Si1	H5	107.499
H3	Si1	H4	111.370	H3	Si1	H5	111.370
H4	Si1	H5	111.370	Cl6	C2	Cl7	109.386
Cl6	C2	Cl8	109.386	Cl7	C2	Cl8	109.386

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

using model chemistry: CCD/cc-pVDZ

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 SiH3CCl3 ((trichloromethyl)silane)

using model chemistry: CCD/cc-pVDZ

States and conformations

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