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	hartrees
Energy at 0K	-1417.694949
Energy at 298.15K	-1417.696707
HF Energy	-1416.890158
Nuclear repulsion energy	264.414833

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3238	3049	0.50
2	A₁	696	656	5.30
3	A₁	381	358	0.42
4	E	1286	1211	24.09
4	E	1286	1211	24.08
5	E	831	783	128.03
5	E	831	783	128.03
6	E	270	255	0.15
6	E	270	255	0.15

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.460
H2	0.000	0.000	1.506
Cl3	0.000	1.590	-0.084
Cl4	1.377	-0.795	-0.084
Cl5	-1.377	-0.795	-0.084

	C1	H2	Cl3	Cl4	Cl5
C1		1.0460	1.6804	1.6804	1.6804
H2	1.0460		2.2485	2.2485	2.2485
Cl3	1.6804	2.2485		2.7537	2.7537
Cl4	1.6804	2.2485	2.7537		2.7537
Cl5	1.6804	2.2485	2.7537	2.7537

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	Cl3	108.888	H2	C1	Cl4	108.888
H2	C1	Cl5	108.888	Cl3	C1	Cl4	110.048
Cl3	C1	Cl5	110.048	Cl4	C1	Cl5	110.048

All results from a given calculation for CHCl₃ (Chloroform)

using model chemistry: CCSD=FULL/6-31G(2df,p)

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 CHCl3 (Chloroform)

using model chemistry: CCSD=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for CHCl₃ (Chloroform)