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	hartrees
Energy at 0K	-117.541663
Energy at 298.15K	-117.548035
HF Energy	-117.077242
Nuclear repulsion energy	75.363003

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3135	3135
2	A₁'	1543	1543
3	A₁'	1220	1220
4	A₁"	1170	1170
5	A₂'	1083	1083
6	A₂"	3226	3226
7	A₂"	858	858
8	E'	3123	3123
8	E'	3123	3123
9	E'	1489	1489
9	E'	1489	1489
10	E'	1079	1079
10	E'	1078	1078
11	E'	895	895
11	E'	894	894
12	E"	3206	3206
12	E"	3205	3205
13	E"	1226	1226
13	E"	1226	1226
14	E"	755	755
14	E"	754	754

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.875	0.000
C2	0.758	-0.437	0.000
C3	-0.758	-0.437	0.000
H4	0.000	1.463	0.915
H5	1.267	-0.732	0.915
H6	-1.267	-0.732	0.915
H7	0.000	1.463	-0.915
H8	1.267	-0.732	-0.915
H9	-1.267	-0.732	-0.915

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5152	1.5152	1.0881	2.2414	2.2414	1.0881	2.2414	2.2414
C2	1.5152		1.5152	2.2414	1.0881	2.2414	2.2414	1.0881	2.2414
C3	1.5152	1.5152		2.2414	2.2414	1.0881	2.2414	2.2414	1.0881
H4	1.0881	2.2414	2.2414		2.5341	2.5341	1.8308	3.1263	3.1263
H5	2.2414	1.0881	2.2414	2.5341		2.5341	3.1263	1.8308	3.1263
H6	2.2414	2.2414	1.0881	2.5341	2.5341		3.1263	3.1263	1.8308
H7	1.0881	2.2414	2.2414	1.8308	3.1263	3.1263		2.5341	2.5341
H8	2.2414	1.0881	2.2414	3.1263	1.8308	3.1263	2.5341		2.5341
H9	2.2414	2.2414	1.0881	3.1263	3.1263	1.8308	2.5341	2.5341

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.917
C1	C2	H8	117.917	C1	C3	C2	60.000
C1	C3	H6	117.917	C1	C3	H9	117.917
C2	C1	C3	60.000	C2	C1	H4	117.917
C2	C1	H7	117.917	C2	C3	H6	117.917
C2	C3	H9	117.917	C3	C1	H4	117.917
C3	C1	H7	117.917	C3	C2	H5	117.917
C3	C2	H8	117.917	H4	C1	H7	114.548
H5	C2	H8	114.548	H6	C3	H9	114.548

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)