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	hartrees
Energy at 0K	-156.699867
Energy at 298.15K
HF Energy	-156.127053
Nuclear repulsion energy	119.659230

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.119
C2	0.000	0.000	1.463
H3	0.000	0.924	2.026
H4	0.000	-0.924	2.026
C5	0.000	1.274	-0.680
C6	0.000	-1.274	-0.680
H7	0.000	2.151	-0.034
H8	0.878	1.321	-1.328
H9	-0.878	1.321	-1.328
H10	0.000	-2.151	-0.034
H11	-0.878	-1.321	-1.328
H12	0.878	-1.321	-1.328

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10	H11	H12
C1		1.3437	2.1192	2.1192	1.5038	1.5038	2.1565	2.1471	2.1471	2.1565	2.1471	2.1471
C2	1.3437		1.0823	1.0823	2.4928	2.4928	2.6206	3.2100	3.2100	2.6206	3.2100	3.2100
H3	2.1192	1.0823		1.8481	2.7287	3.4864	2.3980	3.4898	3.4898	3.7014	4.1306	4.1306
H4	2.1192	1.0823	1.8481		3.4864	2.7287	3.7014	4.1306	4.1306	2.3980	3.4898	3.4898
C5	1.5038	2.4928	2.7287	3.4864		2.5479	1.0893	1.0924	1.0924	3.4854	2.8152	2.8152
C6	1.5038	2.4928	3.4864	2.7287	2.5479		3.4854	2.8152	2.8152	1.0893	1.0924	1.0924
H7	2.1565	2.6206	2.3980	3.7014	1.0893	3.4854		1.7704	1.7704	4.3021	3.8080	3.8080
H8	2.1471	3.2100	3.4898	4.1306	1.0924	2.8152	1.7704		1.7566	3.8080	3.1727	2.6421
H9	2.1471	3.2100	3.4898	4.1306	1.0924	2.8152	1.7704	1.7566		3.8080	2.6421	3.1727
H10	2.1565	2.6206	3.7014	2.3980	3.4854	1.0893	4.3021	3.8080	3.8080		1.7704	1.7704
H11	2.1471	3.2100	4.1306	3.4898	2.8152	1.0924	3.8080	3.1727	2.6421	1.7704		1.7566
H12	2.1471	3.2100	4.1306	3.4898	2.8152	1.0924	3.8080	2.6421	3.1727	1.7704	1.7566

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H3	121.375	C1	C2	H4	121.375
C1	C5	H7	111.533	C1	C5	H8	110.587
C1	C5	H9	110.587	C1	C6	H10	111.533
C1	C6	H11	110.587	C1	C6	H12	110.587
C2	C1	C5	122.096	C2	C1	C6	122.096
H3	C2	H4	117.250	C5	C1	C6	115.808
H7	C5	H8	108.482	H7	C5	H9	108.482
H8	C5	H9	107.027	H10	C6	H11	108.482
H10	C6	H12	108.482	H11	C6	H12	107.027

All results from a given calculation for CH₂C(CH₃)CH₃ (1-Propene, 2-methyl-)

using model chemistry: MP2/6-31+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 CH2C(CH3)CH3 (1-Propene, 2-methyl-)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for CH₂C(CH₃)CH₃ (1-Propene, 2-methyl-)