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	hartrees
Energy at 0K	-1710.051419
Energy at 298.15K	-1710.054679
HF Energy	-1710.051419
Nuclear repulsion energy	437.790317

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3052	2938	0.00
2	A₁	1325	1275	33.61
3	A₁	761	732	76.79
4	A₁	443	427	24.14
5	A₁	235	227	13.77
6	A₂	174	167	0.00
7	E	3140	3023	0.76
7	E	3140	3023	0.76
8	E	1463	1408	6.21
8	E	1463	1408	6.21
9	E	843	811	92.71
9	E	843	811	92.70
10	E	573	551	166.09
10	E	573	551	166.11
11	E	221	213	3.95
11	E	221	213	3.95
12	E	158	152	0.48
12	E	158	152	0.48

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.258
C2	0.000	0.000	2.106
Cl3	0.000	1.920	-0.465
Cl4	1.662	-0.960	-0.465
Cl5	-1.662	-0.960	-0.465
H6	0.000	-1.024	2.488
H7	0.887	0.512	2.488
H8	-0.887	0.512	2.488

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8479	2.0511	2.0511	2.0511	2.4538	2.4538	2.4538
C2	1.8479		3.2082	3.2082	3.2082	1.0929	1.0929	1.0929
Cl3	2.0511	3.2082		3.3249	3.3249	4.1692	3.3890	3.3890
Cl4	2.0511	3.2082	3.3249		3.3249	3.3890	3.3890	4.1692
Cl5	2.0511	3.2082	3.3249	3.3249		3.3890	4.1692	3.3890
H6	2.4538	1.0929	4.1692	3.3890	3.3890		1.7735	1.7735
H7	2.4538	1.0929	3.3890	3.3890	4.1692	1.7735		1.7735
H8	2.4538	1.0929	3.3890	4.1692	3.3890	1.7735	1.7735

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.461	Si1	C2	H7	110.461
Si1	C2	H8	110.461	C2	Si1	Cl3	110.627
C2	Si1	Cl4	110.627	C2	Si1	Cl5	110.627
Cl3	Si1	Cl4	108.292	Cl3	Si1	Cl5	108.292
Cl4	Si1	Cl5	108.292	H6	C2	H7	108.464
H6	C2	H8	108.464	H7	C2	H8	108.464

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: B3PW91/6-311G*

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	0.939
2	C	-0.981
3	Cl	-0.258
4	Cl	-0.258
5	Cl	-0.258
6	H	0.272
7	H	0.272
8	H	0.272

<r²>	284.851
(<r²>)^1/2	16.878

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: B3PW91/6-311G*

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)