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	hartrees
Energy at 0K	-116.706999
Energy at 298.15K	-116.713379
HF Energy	-116.399475
Nuclear repulsion energy	74.724963

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3158	3035	0.00
2	A₁'	1560	1500	0.00
3	A₁'	1128	1084	0.00
4	A₁"	1193	1146	0.00
5	A₂'	1158	1113	0.00
6	A₂"	3247	3121	25.52
7	A₂"	868	835	0.55
8	E'	3146	3024	16.40
8	E'	3146	3024	16.40
9	E'	1537	1477	2.04
9	E'	1537	1477	2.04
10	E'	1131	1087	17.52
10	E'	1131	1087	17.52
11	E'	838	806	14.42
11	E'	838	806	14.42
12	E"	3225	3100	0.00
12	E"	3225	3100	0.00
13	E"	1240	1192	0.00
13	E"	1240	1192	0.00
14	E"	781	751	0.00
14	E"	781	751	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.887	0.000
C2	0.768	-0.444	0.000
C3	-0.768	-0.444	0.000
H4	0.000	1.472	0.916
H5	1.274	-0.736	0.916
H6	-1.274	-0.736	0.916
H7	0.000	1.472	-0.916
H8	1.274	-0.736	-0.916
H9	-1.274	-0.736	-0.916

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5365	1.5365	1.0867	2.2577	2.2577	1.0867	2.2577	2.2577
C2	1.5365		1.5365	2.2577	1.0867	2.2577	2.2577	1.0867	2.2577
C3	1.5365	1.5365		2.2577	2.2577	1.0867	2.2577	2.2577	1.0867
H4	1.0867	2.2577	2.2577		2.5490	2.5490	1.8323	3.1392	3.1392
H5	2.2577	1.0867	2.2577	2.5490		2.5490	3.1392	1.8323	3.1392
H6	2.2577	2.2577	1.0867	2.5490	2.5490		3.1392	3.1392	1.8323
H7	1.0867	2.2577	2.2577	1.8323	3.1392	3.1392		2.5490	2.5490
H8	2.2577	1.0867	2.2577	3.1392	1.8323	3.1392	2.5490		2.5490
H9	2.2577	2.2577	1.0867	3.1392	3.1392	1.8323	2.5490	2.5490

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.764
C1	C2	H8	117.764	C1	C3	C2	60.000
C1	C3	H6	117.764	C1	C3	H9	117.764
C2	C1	C3	60.000	C2	C1	H4	117.764
C2	C1	H7	117.764	C2	C3	H6	117.764
C2	C3	H9	117.764	C3	C1	H4	117.764
C3	C1	H7	117.764	C3	C2	H5	117.764
C3	C2	H8	117.764	H4	C1	H7	114.919
H5	C2	H8	114.919	H6	C3	H9	114.919

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: QCISD/3-21G*

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/3-21G*

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)