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	hartrees
Energy at 0K	-1710.282113
Energy at 298.15K	-1710.285412
HF Energy	-1710.282113
Nuclear repulsion energy	438.826047

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3066	2933	0.20
2	A₁	1307	1251	32.14
3	A₁	765	732	78.14
4	A₁	449	429	24.26
5	A₁	237	227	14.31
6	A₂	178	170	0.00
7	E	3160	3023	0.17
7	E	3160	3023	0.17
8	E	1448	1386	5.27
8	E	1448	1386	5.26
9	E	832	796	92.69
9	E	832	796	92.68
10	E	579	554	164.21
10	E	579	554	164.21
11	E	222	212	4.11
11	E	222	212	4.11
12	E	159	152	0.46
12	E	159	152	0.46

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.258
C2	0.000	0.000	2.102
Cl3	0.000	1.915	-0.464
Cl4	1.658	-0.957	-0.464
Cl5	-1.658	-0.957	-0.464
H6	0.000	-1.025	2.477
H7	0.888	0.512	2.477
H8	-0.888	0.512	2.477

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8439	2.0465	2.0465	2.0465	2.4442	2.4442	2.4442
C2	1.8439		3.2014	3.2014	3.2014	1.0915	1.0915	1.0915
Cl3	2.0465	3.2014		3.3169	3.3169	4.1582	3.3767	3.3767
Cl4	2.0465	3.2014	3.3169		3.3169	3.3767	3.3767	4.1582
Cl5	2.0465	3.2014	3.3169	3.3169		3.3767	4.1582	3.3767
H6	2.4442	1.0915	4.1582	3.3767	3.3767		1.7753	1.7753
H7	2.4442	1.0915	3.3767	3.3767	4.1582	1.7753		1.7753
H8	2.4442	1.0915	3.3767	4.1582	3.3767	1.7753	1.7753

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.100	Si1	C2	H7	110.100
Si1	C2	H8	110.100	C2	Si1	Cl3	110.649
C2	Si1	Cl4	110.649	C2	Si1	Cl5	110.649
Cl3	Si1	Cl4	108.268	Cl3	Si1	Cl5	108.268
Cl4	Si1	Cl5	108.268	H6	C2	H7	108.835
H6	C2	H8	108.835	H7	C2	H8	108.835

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: mPW1PW91/6-311G**

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	0.881
2	C	-0.632
3	Cl	-0.259
4	Cl	-0.259
5	Cl	-0.259
6	H	0.175
7	H	0.175
8	H	0.175

<r²>	283.593
(<r²>)^1/2	16.840

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: mPW1PW91/6-311G**

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)