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	hartrees
Energy at 0K	-1707.929534
Energy at 298.15K	-1707.932923
HF Energy	-1707.248821
Nuclear repulsion energy	439.711292

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3057	2920	0.03
2	A₁	1368	1306	39.09
3	A₁	784	749	78.97
4	A₁	461	440	23.31
5	A₁	244	233	16.26
6	A₂	178	170	0.00
7	E	3148	3006	0.99
7	E	3148	3006	0.99
8	E	1483	1417	6.68
8	E	1483	1417	6.68
9	E	863	824	94.97
9	E	863	824	94.98
10	E	598	572	166.35
10	E	598	572	166.35
11	E	228	218	5.53
11	E	228	218	5.53
12	E	164	157	0.29
12	E	164	157	0.29

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.253
C2	0.000	0.000	2.097
Cl3	0.000	1.911	-0.462
Cl4	1.655	-0.956	-0.462
Cl5	-1.655	-0.956	-0.462
H6	0.000	-1.025	2.482
H7	0.888	0.512	2.482
H8	-0.888	0.512	2.482

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8442	2.0404	2.0404	2.0404	2.4536	2.4536	2.4536
C2	1.8442		3.1939	3.1939	3.1939	1.0948	1.0948	1.0948
Cl3	2.0404	3.1939		3.3100	3.3100	4.1579	3.3782	3.3782
Cl4	2.0404	3.1939	3.3100		3.3100	3.3782	3.3782	4.1579
Cl5	2.0404	3.1939	3.3100	3.3100		3.3782	4.1579	3.3782
H6	2.4536	1.0948	4.1579	3.3782	3.3782		1.7751	1.7751
H7	2.4536	1.0948	3.3782	3.3782	4.1579	1.7751		1.7751
H8	2.4536	1.0948	3.3782	4.1579	3.3782	1.7751	1.7751

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.596	Si1	C2	H7	110.596
Si1	C2	H8	110.596	C2	Si1	Cl3	110.509
C2	Si1	Cl4	110.509	C2	Si1	Cl5	110.509
Cl3	Si1	Cl4	108.414	Cl3	Si1	Cl5	108.414
Cl4	Si1	Cl5	108.414	H6	C2	H7	108.323
H6	C2	H8	108.323	H7	C2	H8	108.323

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: CCD/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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All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: CCD/6-311G*

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)