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	hartrees
Energy at 0K	-117.530893
Energy at 298.15K	-117.537333
HF Energy	-117.068882
Nuclear repulsion energy	75.890364

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3233	3031	0.00
2	A₁'	1596	1497	0.00
3	A₁'	1261	1182	0.00
4	A₁"	1204	1129	0.00
5	A₂'	1136	1065	0.00
6	A₂"	3325	3117	36.63
7	A₂"	882	827	0.03
8	E'	3222	3021	22.78
8	E'	3222	3021	22.78
9	E'	1536	1440	0.11
9	E'	1536	1440	0.11
10	E'	1129	1058	5.88
10	E'	1129	1058	5.88
11	E'	932	874	17.53
11	E'	932	874	17.53
12	E"	3307	3101	0.00
12	E"	3307	3101	0.00
13	E"	1259	1181	0.00
13	E"	1259	1181	0.00
14	E"	769	721	0.00
14	E"	769	721	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.868	0.000
C2	0.752	-0.434	0.000
C3	-0.752	-0.434	0.000
H4	0.000	1.455	0.908
H5	1.260	-0.728	0.908
H6	-1.260	-0.728	0.908
H7	0.000	1.455	-0.908
H8	1.260	-0.728	-0.908
H9	-1.260	-0.728	-0.908

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5040	1.5040	1.0808	2.2270	2.2270	1.0808	2.2270	2.2270
C2	1.5040		1.5040	2.2270	1.0808	2.2270	2.2270	1.0808	2.2270
C3	1.5040	1.5040		2.2270	2.2270	1.0808	2.2270	2.2270	1.0808
H4	1.0808	2.2270	2.2270		2.5207	2.5207	1.8151	3.1062	3.1062
H5	2.2270	1.0808	2.2270	2.5207		2.5207	3.1062	1.8151	3.1062
H6	2.2270	2.2270	1.0808	2.5207	2.5207		3.1062	3.1062	1.8151
H7	1.0808	2.2270	2.2270	1.8151	3.1062	3.1062		2.5207	2.5207
H8	2.2270	1.0808	2.2270	3.1062	1.8151	3.1062	2.5207		2.5207
H9	2.2270	2.2270	1.0808	3.1062	3.1062	1.8151	2.5207	2.5207

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.056
C1	C2	H8	118.056	C1	C3	C2	60.000
C1	C3	H6	118.056	C1	C3	H9	118.056
C2	C1	C3	60.000	C2	C1	H4	118.056
C2	C1	H7	118.056	C2	C3	H6	118.056
C2	C3	H9	118.056	C3	C1	H4	118.056
C3	C1	H7	118.056	C3	C2	H5	118.056
C3	C2	H8	118.056	H4	C1	H7	114.211
H5	C2	H8	114.211	H6	C3	H9	114.211

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCD/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: CCD/6-31G**

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)