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	hartrees
Energy at 0K	-117.496629
Energy at 298.15K	-117.503019
HF Energy	-117.057857
Nuclear repulsion energy	75.486952

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3163	3034
2	A₁'	1566	1502
3	A₁'	1240	1190
4	A₁"	1181	1133
5	A₂'	1106	1061
6	A₂"	3249	3116
7	A₂"	873	837
8	E'	3152	3024
8	E'	3152	3024
9	E'	1512	1450
9	E'	1512	1450
10	E'	1100	1056
10	E'	1100	1055
11	E'	911	874
11	E'	911	874
12	E"	3230	3099
12	E"	3230	3099
13	E"	1239	1189
13	E"	1239	1189
14	E"	759	728
14	E"	759	728

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.872	0.000
C2	0.755	-0.436	0.000
C3	-0.755	-0.436	0.000
H4	0.000	1.464	0.914
H5	1.268	-0.732	0.914
H6	-1.268	-0.732	0.914
H7	0.000	1.464	-0.914
H8	1.268	-0.732	-0.914
H9	-1.268	-0.732	-0.914

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5103	1.5103	1.0890	2.2396	2.2396	1.0890	2.2396	2.2396
C2	1.5103		1.5103	2.2396	1.0890	2.2396	2.2396	1.0890	2.2396
C3	1.5103	1.5103		2.2396	2.2396	1.0890	2.2396	2.2396	1.0890
H4	1.0890	2.2396	2.2396		2.5361	2.5361	1.8277	3.1260	3.1260
H5	2.2396	1.0890	2.2396	2.5361		2.5361	3.1260	1.8277	3.1260
H6	2.2396	2.2396	1.0890	2.5361	2.5361		3.1260	3.1260	1.8277
H7	1.0890	2.2396	2.2396	1.8277	3.1260	3.1260		2.5361	2.5361
H8	2.2396	1.0890	2.2396	3.1260	1.8277	3.1260	2.5361		2.5361
H9	2.2396	2.2396	1.0890	3.1260	3.1260	1.8277	2.5361	2.5361

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.100
C1	C2	H8	118.100	C1	C3	C2	60.000
C1	C3	H6	118.100	C1	C3	H9	118.100
C2	C1	C3	60.000	C2	C1	H4	118.100
C2	C1	H7	118.100	C2	C3	H6	118.100
C2	C3	H9	118.100	C3	C1	H4	118.100
C3	C1	H7	118.100	C3	C2	H5	118.100
C3	C2	H8	118.100	H4	C1	H7	114.104
H5	C2	H8	114.104	H6	C3	H9	114.104

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: QCISD(T)/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: QCISD(T)/6-31G*

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)