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	hartrees
Energy at 0K	-1701.379670
Energy at 298.15K	-1701.383025
HF Energy	-1701.172238
Nuclear repulsion energy	433.128240

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2341	2341	43.07
2	A₁	956	956	270.10
3	A₁	883	883	19.94
4	A₁	412	412	8.61
5	A₁	283	283	8.93
6	A₂	208	208	0.00
7	E	2363	2363	82.24
7	E	2363	2363	82.24
8	E	968	968	60.12
8	E	968	968	60.12
9	E	726	726	16.01
9	E	726	726	16.00
10	E	605	605	102.82
10	E	605	605	102.78
11	E	270	270	0.00
11	E	270	270	0.00
12	E	169	169	0.00
12	E	169	169	0.00

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.876
C2	0.000	0.000	-0.035
H3	0.000	-1.409	2.314
H4	1.220	0.704	2.314
H5	-1.220	0.704	2.314
Cl6	0.000	1.708	-0.647
Cl7	1.479	-0.854	-0.647
Cl8	-1.479	-0.854	-0.647

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9107	1.4754	1.4754	1.4754	3.0465	3.0465	3.0465
C2	1.9107		2.7394	2.7394	2.7394	1.8146	1.8146	1.8146
H3	1.4754	2.7394		2.4398	2.4398	4.2993	3.3563	3.3563
H4	1.4754	2.7394	2.4398		2.4398	3.3563	3.3563	4.2993
H5	1.4754	2.7394	2.4398	2.4398		3.3563	4.2993	3.3563
Cl6	3.0465	1.8146	4.2993	3.3563	3.3563		2.9590	2.9590
Cl7	3.0465	1.8146	3.3563	3.3563	4.2993	2.9590		2.9590
Cl8	3.0465	1.8146	3.3563	4.2993	3.3563	2.9590	2.9590

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.701	Si1	C2	Cl7	109.701
Si1	C2	Cl8	109.701	C2	Si1	H3	107.304
C2	Si1	H4	107.304	C2	Si1	H5	107.304
H3	Si1	H4	111.549	H3	Si1	H5	111.549
H4	Si1	H5	111.549	Cl6	C2	Cl7	109.241
Cl6	C2	Cl8	109.241	Cl7	C2	Cl8	109.241

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

using model chemistry: B2PLYP=FULL/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 SiH3CCl3 ((trichloromethyl)silane)

using model chemistry: B2PLYP=FULL/3-21G*

States and conformations

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