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	hartrees
Energy at 0K	-117.553490
Energy at 298.15K	-117.559894
HF Energy	-117.070687
Nuclear repulsion energy	75.594119

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3199	3004
2	A₁'	1566	1471
3	A₁'	1231	1156
4	A₁"	1186	1114
5	A₂'	1111	1043
6	A₂"	3292	3092
7	A₂"	873	820
8	E'	3188	2993
8	E'	3188	2993
9	E'	1512	1420
9	E'	1512	1419
10	E'	1107	1039
10	E'	1107	1039
11	E'	901	846
11	E'	900	845
12	E"	3273	3074
12	E"	3273	3073
13	E"	1239	1164
13	E"	1239	1164
14	E"	764	717
14	E"	763	717

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.873	0.000
C2	0.756	-0.436	0.000
C3	-0.756	-0.436	0.000
H4	0.000	1.459	0.911
H5	1.263	-0.729	0.911
H6	-1.263	-0.729	0.911
H7	0.000	1.459	-0.911
H8	1.263	-0.729	-0.911
H9	-1.263	-0.729	-0.911

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5115	1.5115	1.0832	2.2344	2.2344	1.0832	2.2344	2.2344
C2	1.5115		1.5115	2.2344	1.0832	2.2344	2.2344	1.0832	2.2344
C3	1.5115	1.5115		2.2344	2.2344	1.0832	2.2344	2.2344	1.0832
H4	1.0832	2.2344	2.2344		2.5267	2.5267	1.8218	3.1150	3.1150
H5	2.2344	1.0832	2.2344	2.5267		2.5267	3.1150	1.8218	3.1150
H6	2.2344	2.2344	1.0832	2.5267	2.5267		3.1150	3.1150	1.8218
H7	1.0832	2.2344	2.2344	1.8218	3.1150	3.1150		2.5267	2.5267
H8	2.2344	1.0832	2.2344	3.1150	1.8218	3.1150	2.5267		2.5267
H9	2.2344	2.2344	1.0832	3.1150	3.1150	1.8218	2.5267	2.5267

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.945
C1	C2	H8	117.945	C1	C3	C2	60.000
C1	C3	H6	117.945	C1	C3	H9	117.945
C2	C1	C3	60.000	C2	C1	H4	117.945
C2	C1	H7	117.945	C2	C3	H6	117.945
C2	C3	H9	117.945	C3	C1	H4	117.945
C3	C1	H7	117.945	C3	C2	H5	117.945
C3	C2	H8	117.945	H4	C1	H7	114.481
H5	C2	H8	114.481	H6	C3	H9	114.481

All results from a given calculation for C₃H₆ (Cyclopropane)

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

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)/6-31+G**

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)