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	hartrees
Energy at 0K	-1710.046076
Energy at 298.15K	-1710.048978
HF Energy	-1710.046076
Nuclear repulsion energy	416.321004

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3072	2955	0.21
2	A₁	1375	1323	16.80
3	A₁	731	703	53.70
4	A₁	382	368	21.38
5	A₁	198	190	19.36
6	A₂	155	149	0.00
7	E	3175	3054	0.00
7	E	3175	3054	0.00
8	E	1493	1437	9.16
8	E	1493	1437	9.15
9	E	915	880	83.50
9	E	915	880	83.50
10	E	515	495	126.71
10	E	515	495	126.71
11	E	194	187	4.82
11	E	194	187	4.82
12	E	133	128	1.28
12	E	133	128	1.28

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.286
C2	0.000	0.000	2.173
Cl3	0.000	2.033	-0.484
Cl4	1.761	-1.016	-0.484
Cl5	-1.761	-1.016	-0.484
H6	0.000	-1.030	2.541
H7	0.892	0.515	2.541
H8	-0.892	0.515	2.541

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8877	2.1737	2.1737	2.1737	2.4795	2.4795	2.4795
C2	1.8877		3.3455	3.3455	3.3455	1.0935	1.0935	1.0935
Cl3	2.1737	3.3455		3.5212	3.5212	4.3047	3.5000	3.5000
Cl4	2.1737	3.3455	3.5212		3.5212	3.5000	3.5000	4.3047
Cl5	2.1737	3.3455	3.5212	3.5212		3.5000	4.3047	3.5000
H6	2.4795	1.0935	4.3047	3.5000	3.5000		1.7836	1.7836
H7	2.4795	1.0935	3.5000	3.5000	4.3047	1.7836		1.7836
H8	2.4795	1.0935	3.5000	4.3047	3.5000	1.7836	1.7836

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	109.659	Si1	C2	H7	109.659
Si1	C2	H8	109.659	C2	Si1	Cl3	110.727
C2	Si1	Cl4	110.727	C2	Si1	Cl5	110.727
Cl3	Si1	Cl4	108.187	Cl3	Si1	Cl5	108.187
Cl4	Si1	Cl5	108.187	H6	C2	H7	109.282
H6	C2	H8	109.282	H7	C2	H8	109.282

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: B3LYP/6-31G

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	0.757
2	C	-0.706
3	Cl	-0.233
4	Cl	-0.233
5	Cl	-0.233
6	H	0.216
7	H	0.216
8	H	0.216

<r²>	312.550
(<r²>)^1/2	17.679

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: B3LYP/6-31G

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)