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	hartrees
Energy at 0K	-117.522401
Energy at 298.15K	-117.528877
HF Energy	-117.097171
Nuclear repulsion energy	76.212741

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3248	3248	0.00
2	A₁'	1595	1595	0.00
3	A₁'	1262	1262	0.00
4	A₁"	1219	1219	0.00
5	A₂'	1163	1163	0.00
6	A₂"	3341	3341	32.85
7	A₂"	895	895	0.02
8	E'	3237	3237	21.55
8	E'	3237	3237	21.55
9	E'	1537	1537	0.70
9	E'	1537	1537	0.70
10	E'	1137	1137	7.24
10	E'	1137	1137	7.24
11	E'	931	931	23.89
11	E'	931	931	23.89
12	E"	3321	3321	0.00
12	E"	3321	3321	0.00
13	E"	1272	1272	0.00
13	E"	1272	1272	0.00
14	E"	786	786	0.00
14	E"	786	786	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.865	0.000
C2	0.749	-0.432	0.000
C3	-0.749	-0.432	0.000
H4	0.000	1.446	0.906
H5	1.253	-0.723	0.906
H6	-1.253	-0.723	0.906
H7	0.000	1.446	-0.906
H8	1.253	-0.723	-0.906
H9	-1.253	-0.723	-0.906

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.4980	1.4980	1.0765	2.2161	2.2161	1.0765	2.2161	2.2161
C2	1.4980		1.4980	2.2161	1.0765	2.2161	2.2161	1.0765	2.2161
C3	1.4980	1.4980		2.2161	2.2161	1.0765	2.2161	2.2161	1.0765
H4	1.0765	2.2161	2.2161		2.5050	2.5050	1.8119	3.0916	3.0916
H5	2.2161	1.0765	2.2161	2.5050		2.5050	3.0916	1.8119	3.0916
H6	2.2161	2.2161	1.0765	2.5050	2.5050		3.0916	3.0916	1.8119
H7	1.0765	2.2161	2.2161	1.8119	3.0916	3.0916		2.5050	2.5050
H8	2.2161	1.0765	2.2161	3.0916	1.8119	3.0916	2.5050		2.5050
H9	2.2161	2.2161	1.0765	3.0916	3.0916	1.8119	2.5050	2.5050

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.889
C1	C2	H8	117.889	C1	C3	C2	60.000
C1	C3	H6	117.889	C1	C3	H9	117.889
C2	C1	C3	60.000	C2	C1	H4	117.889
C2	C1	H7	117.889	C2	C3	H6	117.889
C2	C3	H9	117.889	C3	C1	H4	117.889
C3	C1	H7	117.889	C3	C2	H5	117.889
C3	C2	H8	117.889	H4	C1	H7	114.616
H5	C2	H8	114.616	H6	C3	H9	114.616

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CID/TZVP

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: CID/TZVP

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)