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	hartrees
Energy at 0K	-117.663052
Energy at 298.15K	-117.669408
HF Energy	-117.098322
Nuclear repulsion energy	75.677920

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3150	2973
2	A₁'	1524	1438
3	A₁'	1212	1144
4	A₁"	1161	1095
5	A₂'	1088	1027
6	A₂"	3247	3065
7	A₂"	854	806
8	E'	3141	2964
8	E'	3141	2964
9	E'	1477	1394
9	E'	1477	1394
10	E'	1054	995
10	E'	1054	994
11	E'	890	840
11	E'	890	840
12	E"	3228	3046
12	E"	3228	3046
13	E"	1213	1145
13	E"	1213	1145
14	E"	739	698
14	E"	739	697

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	1.455	0.912
H5	1.260	-0.728	0.912
H6	-1.260	-0.728	0.912
H7	0.000	1.455	-0.912
H8	1.260	-0.728	-0.912
H9	-1.260	-0.728	-0.912

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5099	1.5099	1.0825	2.2311	2.2311	1.0825	2.2311	2.2311
C2	1.5099		1.5099	2.2311	1.0825	2.2311	2.2311	1.0825	2.2311
C3	1.5099	1.5099		2.2311	2.2311	1.0825	2.2311	2.2311	1.0825
H4	1.0825	2.2311	2.2311		2.5206	2.5206	1.8236	3.1111	3.1111
H5	2.2311	1.0825	2.2311	2.5206		2.5206	3.1111	1.8236	3.1111
H6	2.2311	2.2311	1.0825	2.5206	2.5206		3.1111	3.1111	1.8236
H7	1.0825	2.2311	2.2311	1.8236	3.1111	3.1111		2.5206	2.5206
H8	2.2311	1.0825	2.2311	3.1111	1.8236	3.1111	2.5206		2.5206
H9	2.2311	2.2311	1.0825	3.1111	3.1111	1.8236	2.5206	2.5206

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.828
C1	C2	H8	117.828	C1	C3	C2	60.000
C1	C3	H6	117.828	C1	C3	H9	117.828
C2	C1	C3	60.000	C2	C1	H4	117.828
C2	C1	H7	117.828	C2	C3	H6	117.828
C2	C3	H9	117.828	C3	C1	H4	117.828
C3	C1	H7	117.828	C3	C2	H5	117.828
C3	C2	H8	117.828	H4	C1	H7	114.764
H5	C2	H8	114.764	H6	C3	H9	114.764

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: MP4/6-311+G(3df,2p)

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: MP4/6-311+G(3df,2p)

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)