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	hartrees
Energy at 0K	-117.438469
Energy at 298.15K	-117.444928
HF Energy	-117.058672
Nuclear repulsion energy	75.956413

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3248	3007	0.00
2	A₁'	1614	1494	0.00
3	A₁'	1280	1185	0.00
4	A₁"	1216	1126	0.00
5	A₂'	1155	1069	0.00
6	A₂"	3333	3085	36.35
7	A₂"	896	829	0.23
8	E'	3235	2995	23.83
8	E'	3235	2995	23.83
9	E'	1552	1437	0.64
9	E'	1552	1437	0.64
10	E'	1140	1055	7.33
10	E'	1140	1055	7.33
11	E'	945	875	20.72
11	E'	945	875	20.72
12	E"	3314	3068	0.00
12	E"	3314	3068	0.00
13	E"	1276	1181	0.00
13	E"	1276	1181	0.00
14	E"	781	723	0.00
14	E"	781	723	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.867	0.000
C2	0.750	-0.433	0.000
C3	-0.750	-0.433	0.000
H4	0.000	1.455	0.908
H5	1.260	-0.728	0.908
H6	-1.260	-0.728	0.908
H7	0.000	1.455	-0.908
H8	1.260	-0.728	-0.908
H9	-1.260	-0.728	-0.908

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5008	1.5008	1.0822	2.2258	2.2258	1.0822	2.2258	2.2258
C2	1.5008		1.5008	2.2258	1.0822	2.2258	2.2258	1.0822	2.2258
C3	1.5008	1.5008		2.2258	2.2258	1.0822	2.2258	2.2258	1.0822
H4	1.0822	2.2258	2.2258		2.5208	2.5208	1.8159	3.1067	3.1067
H5	2.2258	1.0822	2.2258	2.5208		2.5208	3.1067	1.8159	3.1067
H6	2.2258	2.2258	1.0822	2.5208	2.5208		3.1067	3.1067	1.8159
H7	1.0822	2.2258	2.2258	1.8159	3.1067	3.1067		2.5208	2.5208
H8	2.2258	1.0822	2.2258	3.1067	1.8159	3.1067	2.5208		2.5208
H9	2.2258	2.2258	1.0822	3.1067	3.1067	1.8159	2.5208	2.5208

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.114
C1	C2	H8	118.114	C1	C3	C2	60.000
C1	C3	H6	118.114	C1	C3	H9	118.114
C2	C1	C3	60.000	C2	C1	H4	118.114
C2	C1	H7	118.114	C2	C3	H6	118.114
C2	C3	H9	118.114	C3	C1	H4	118.114
C3	C1	H7	118.114	C3	C2	H5	118.114
C3	C2	H8	118.114	H4	C1	H7	114.069
H5	C2	H8	114.069	H6	C3	H9	114.069

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CISD/6-31G*

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 C3H6 (Cyclopropane)

using model chemistry: CISD/6-31G*

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)