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	hartrees
Energy at 0K	-1710.387167
Energy at 298.15K	-1710.390453
HF Energy	-1710.387167
Nuclear repulsion energy	439.906428

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3073	2945	0.01
2	A₁	1326	1271	35.07
3	A₁	771	739	78.71
4	A₁	451	433	24.30
5	A₁	236	226	14.06
6	A₂	177	170	0.00
7	E	3164	3033	0.71
7	E	3164	3033	0.71
8	E	1467	1406	5.92
8	E	1467	1406	5.92
9	E	839	805	94.60
9	E	839	805	94.55
10	E	583	559	167.31
10	E	583	559	167.26
11	E	220	211	4.24
11	E	220	211	4.24
12	E	158	152	0.41
12	E	158	152	0.41

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.257
C2	0.000	0.000	2.097
Cl3	0.000	1.910	-0.463
Cl4	1.654	-0.955	-0.463
Cl5	-1.654	-0.955	-0.463
H6	0.000	-1.021	2.477
H7	0.885	0.511	2.477
H8	-0.885	0.511	2.477

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8403	2.0409	2.0409	2.0409	2.4442	2.4442	2.4442
C2	1.8403		3.1939	3.1939	3.1939	1.0899	1.0899	1.0899
Cl3	2.0409	3.1939		3.3079	3.3079	4.1518	3.3742	3.3742
Cl4	2.0409	3.1939	3.3079		3.3079	3.3742	3.3742	4.1518
Cl5	2.0409	3.1939	3.3079	3.3079		3.3742	4.1518	3.3742
H6	2.4442	1.0899	4.1518	3.3742	3.3742		1.7692	1.7692
H7	2.4442	1.0899	3.3742	3.3742	4.1518	1.7692		1.7692
H8	2.4442	1.0899	3.3742	4.1518	3.3742	1.7692	1.7692

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.417	Si1	C2	H7	110.417
Si1	C2	H8	110.417	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	108.509
H6	C2	H8	108.509	H7	C2	H8	108.509

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: B1B95/6-311G*

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	0.907
2	C	-0.970
3	Cl	-0.249
4	Cl	-0.249
5	Cl	-0.249
6	H	0.270
7	H	0.270
8	H	0.270

<r²>	282.358
(<r²>)^1/2	16.803

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: B1B95/6-311G*

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)