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	hartrees
Energy at 0K	-117.589669
Energy at 298.15K	-117.596057
HF Energy	-117.087503
Nuclear repulsion energy	75.375411

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3152	3152
2	A₁'	1537	1537
3	A₁'	1219	1219
4	A₁"	1172	1172
5	A₂'	1094	1094
6	A₂"	3246	3246
7	A₂"	864	864
8	E'	3142	3142
8	E'	3141	3141
9	E'	1484	1484
9	E'	1483	1483
10	E'	1086	1086
10	E'	1086	1086
11	E'	895	895
11	E'	895	895
12	E"	3225	3225
12	E"	3225	3225
13	E"	1227	1227
13	E"	1227	1227
14	E"	754	754
14	E"	754	754

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.875	0.000
C2	0.758	-0.438	0.000
C3	-0.758	-0.438	0.000
H4	0.000	1.461	0.916
H5	1.265	-0.730	0.916
H6	-1.265	-0.730	0.916
H7	0.000	1.461	-0.916
H8	1.265	-0.730	-0.916
H9	-1.265	-0.730	-0.916

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5160	1.5160	1.0869	2.2399	2.2399	1.0869	2.2399	2.2399
C2	1.5160		1.5160	2.2399	1.0869	2.2399	2.2399	1.0869	2.2399
C3	1.5160	1.5160		2.2399	2.2399	1.0869	2.2399	2.2399	1.0869
H4	1.0869	2.2399	2.2399		2.5302	2.5302	1.8315	3.1235	3.1235
H5	2.2399	1.0869	2.2399	2.5302		2.5302	3.1235	1.8315	3.1235
H6	2.2399	2.2399	1.0869	2.5302	2.5302		3.1235	3.1235	1.8315
H7	1.0869	2.2399	2.2399	1.8315	3.1235	3.1235		2.5302	2.5302
H8	2.2399	1.0869	2.2399	3.1235	1.8315	3.1235	2.5302		2.5302
H9	2.2399	2.2399	1.0869	3.1235	3.1235	1.8315	2.5302	2.5302

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.810
C1	C2	H8	117.810	C1	C3	C2	60.000
C1	C3	H6	117.810	C1	C3	H9	117.810
C2	C1	C3	60.000	C2	C1	H4	117.810
C2	C1	H7	117.810	C2	C3	H6	117.810
C2	C3	H9	117.810	C3	C1	H4	117.810
C3	C1	H7	117.810	C3	C2	H5	117.810
C3	C2	H8	117.810	H4	C1	H7	114.808
H5	C2	H8	114.808	H6	C3	H9	114.808

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: QCISD(TQ)/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 C3H6 (Cyclopropane)

using model chemistry: QCISD(TQ)/6-311G**

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)