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	hartrees
Energy at 0K	-117.284169
Energy at 298.15K	-117.290649
HF Energy	-117.006900
Nuclear repulsion energy	75.157772

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3211	3011	0.00
2	A₁'	1595	1496	0.00
3	A₁'	1241	1163	0.00
4	A₁"	1218	1142	0.00
5	A₂'	1200	1126	0.00
6	A₂"	3294	3089	45.31
7	A₂"	900	844	0.36
8	E'	3193	2994	22.69
8	E'	3193	2994	22.69
9	E'	1563	1465	1.55
9	E'	1563	1465	1.55
10	E'	1175	1102	12.15
10	E'	1175	1102	12.15
11	E'	907	850	22.51
11	E'	907	850	22.51
12	E"	3272	3068	0.00
12	E"	3272	3068	0.00
13	E"	1278	1199	0.00
13	E"	1278	1199	0.00
14	E"	806	756	0.00
14	E"	806	756	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.879	0.000
C2	0.761	-0.439	0.000
C3	-0.761	-0.439	0.000
H4	0.000	1.473	0.909
H5	1.276	-0.737	0.909
H6	-1.276	-0.737	0.909
H7	0.000	1.473	-0.909
H8	1.276	-0.737	-0.909
H9	-1.276	-0.737	-0.909

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5222	1.5222	1.0856	2.2500	2.2500	1.0856	2.2500	2.2500
C2	1.5222		1.5222	2.2500	1.0856	2.2500	2.2500	1.0856	2.2500
C3	1.5222	1.5222		2.2500	2.2500	1.0856	2.2500	2.2500	1.0856
H4	1.0856	2.2500	2.2500		2.5514	2.5514	1.8172	3.1324	3.1324
H5	2.2500	1.0856	2.2500	2.5514		2.5514	3.1324	1.8172	3.1324
H6	2.2500	2.2500	1.0856	2.5514	2.5514		3.1324	3.1324	1.8172
H7	1.0856	2.2500	2.2500	1.8172	3.1324	3.1324		2.5514	2.5514
H8	2.2500	1.0856	2.2500	3.1324	1.8172	3.1324	2.5514		2.5514
H9	2.2500	2.2500	1.0856	3.1324	3.1324	1.8172	2.5514	2.5514

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.294
C1	C2	H8	118.294	C1	C3	C2	60.000
C1	C3	H6	118.294	C1	C3	H9	118.294
C2	C1	C3	60.000	C2	C1	H4	118.294
C2	C1	H7	118.294	C2	C3	H6	118.294
C2	C3	H9	118.294	C3	C1	H4	118.294
C3	C1	H7	118.294	C3	C2	H5	118.294
C3	C2	H8	118.294	H4	C1	H7	113.633
H5	C2	H8	113.633	H6	C3	H9	113.633

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CISD/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: CISD/6-31G

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)