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	hartrees
Energy at 0K	-117.578773
Energy at 298.15K	-117.584362
HF Energy	-117.084768
Nuclear repulsion energy	70.549982

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3298	3298
2	A'	3208	3208
3	A'	3198	3198
4	A'	3177	3177
5	A'	3082	3082
6	A'	1713	1713
7	A'	1539	1539
8	A'	1488	1488
9	A'	1448	1448
10	A'	1340	1340
11	A'	1213	1213
12	A'	962	962
13	A'	942	942
14	A'	424	424
15	A"	3156	3156
16	A"	1517	1517
17	A"	1083	1083
18	A"	1014	1014
19	A"	899	899
20	A"	577	577
21	A"	192	192

Atom	x (Å)	y (Å)	z (Å)
C1	-1.146	-0.492	0.000
C2	0.000	0.481	0.000
C3	1.298	0.131	0.000
H4	1.603	-0.910	0.000
H5	2.085	0.874	0.000
H6	-0.258	1.536	0.000
H7	-0.785	-1.521	0.000
H8	-1.778	-0.349	0.879
H9	-1.778	-0.349	-0.879

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5029	2.5219	2.7801	3.5072	2.2137	1.0908	1.0924	1.0924
C2	1.5029		1.3445	2.1218	2.1213	1.0868	2.1497	2.1506	2.1506
C3	2.5219	1.3445		1.0840	1.0821	2.0975	2.6578	3.2355	3.2355
H4	2.7801	2.1218	1.0840		1.8474	3.0737	2.4640	3.5381	3.5381
H5	3.5072	2.1213	1.0821	1.8474		2.4350	3.7369	4.1463	4.1463
H6	2.2137	1.0868	2.0975	3.0737	2.4350		3.1021	2.5767	2.5767
H7	1.0908	2.1497	2.6578	2.4640	3.7369	3.1021		1.7701	1.7701
H8	1.0924	2.1506	3.2355	3.5381	4.1463	2.5767	1.7701		1.7585
H9	1.0924	2.1506	3.2355	3.5381	4.1463	2.5767	1.7701	1.7585

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.585	C1	C2	H6	116.558
C2	C1	H7	110.964	C2	C1	H8	110.927
C2	C1	H9	110.927	C2	C3	H4	121.415
C2	C3	H5	121.523	C3	C2	H6	118.858
H4	C3	H5	117.062	H7	C1	H8	108.346
H7	C1	H9	108.346	H8	C1	H9	107.196

All results from a given calculation for CH₂CHCH₃ (Propene)

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

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/6-31+G**

States and conformations

All results from a given calculation for CH₂CHCH₃ (Propene)