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	hartrees
Energy at 0K	-1417.679391
Energy at 298.15K	-1417.679353
HF Energy	-1416.956548
Nuclear repulsion energy	261.280218

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2363	2259
2	A₁	657	628
3	A₁	368	351
4	E	950	909
4	E	950	908
5	E	755	722
5	E	755	722
6	E	263	252
6	E	263	252

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.456
H2	0.000	0.000	1.538
Cl3	0.000	1.698	-0.084
Cl4	1.471	-0.849	-0.084
Cl5	-1.471	-0.849	-0.084

	C1	H2	Cl3	Cl4	Cl5
C1		1.0816	1.7820	1.7820	1.7820
H2	1.0816		2.3480	2.3480	2.3480
Cl3	1.7820	2.3480		2.9415	2.9415
Cl4	1.7820	2.3480	2.9415		2.9415
Cl5	1.7820	2.3480	2.9415	2.9415

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
D2	C1	Cl3	107.634	D2	C1	Cl4	107.634
D2	C1	Cl5	107.634	Cl3	C1	Cl4	111.244
Cl3	C1	Cl5	111.244	Cl4	C1	Cl5	111.244

All results from a given calculation for CDCl₃ (trichloromethane-d)

using model chemistry: CCSD(T)=FULL/TZVP

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 CDCl3 (trichloromethane-d)

using model chemistry: CCSD(T)=FULL/TZVP

States and conformations

All results from a given calculation for CDCl₃ (trichloromethane-d)