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	hartrees
Energy at 0K	-117.344615
Energy at 298.15K	-117.350210
HF Energy	-117.025103
Nuclear repulsion energy	69.795320

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3203	3203
2	A'	3121	3121
3	A'	3107	3107
4	A'	3079	3079
5	A'	2999	2999
6	A'	1688	1688
7	A'	1552	1552
8	A'	1493	1493
9	A'	1470	1470
10	A'	1353	1353
11	A'	1217	1217
12	A'	980	980
13	A'	925	925
14	A'	430	430
15	A"	3063	3063
16	A"	1533	1533
17	A"	1108	1108
18	A"	1013	1013
19	A"	919	919
20	A"	584	584
21	A"	185	185

Atom	x (Å)	y (Å)	z (Å)
C1	-1.158	-0.501	0.000
C2	0.000	0.486	0.000
C3	1.311	0.139	0.000
H4	1.630	-0.908	0.000
H5	2.108	0.887	0.000
H6	-0.274	1.548	0.000
H7	-0.785	-1.539	0.000
H8	-1.798	-0.365	0.890
H9	-1.798	-0.365	-0.890

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5215	2.5507	2.8180	3.5490	2.2319	1.1033	1.1044	1.1044
C2	1.5215		1.3560	2.1451	2.1462	1.0976	2.1722	2.1791	2.1791
C3	2.5507	1.3560		1.0952	1.0929	2.1212	2.6857	3.2728	3.2728
H4	2.8180	2.1451	1.0952		1.8576	3.1087	2.4968	3.5832	3.5832
H5	3.5490	2.1462	1.0929	1.8576		2.4730	3.7763	4.1974	4.1974
H6	2.2319	1.0976	2.1212	3.1087	2.4730		3.1300	2.6030	2.6030
H7	1.1033	2.1722	2.6857	2.4968	3.7763	3.1300		1.7877	1.7877
H8	1.1044	2.1791	3.2728	3.5832	4.1974	2.6030	1.7877		1.7799
H9	1.1044	2.1791	3.2728	3.5832	4.1974	2.6030	1.7877	1.7799

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.764	C1	C2	H6	115.953
C2	C1	H7	110.688	C2	C1	H8	111.173
C2	C1	H9	111.173	C2	C3	H4	121.760
C2	C3	H5	122.049	C3	C2	H6	119.283
H4	C3	H5	116.192	H7	C1	H8	108.142
H7	C1	H9	108.142	H8	C1	H9	107.381

All results from a given calculation for CH₂CHCH₃ (Propene)

using model chemistry: MP4=FULL/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 CH2CHCH3 (Propene)

using model chemistry: MP4=FULL/6-31G

States and conformations

All results from a given calculation for CH₂CHCH₃ (Propene)