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	hartrees
Energy at 0K	-156.682391
Energy at 298.15K	-156.691083
HF Energy	-156.108936
Nuclear repulsion energy	124.601746

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3332	3120	20.02
2	A'	3243	3037	17.26
3	A'	3231	3026	11.87
4	A'	3209	3005	15.90
5	A'	3117	2919	27.60
6	A'	1577	1477	0.59
7	A'	1562	1462	5.91
8	A'	1480	1386	2.58
9	A'	1441	1350	2.88
10	A'	1278	1196	0.21
11	A'	1251	1172	0.12
12	A'	1109	1039	7.00
13	A'	1042	975	8.64
14	A'	972	911	2.33
15	A'	826	774	4.67
16	A'	800	749	1.65
17	A'	370	347	0.22
18	A"	3320	3109	0.19
19	A"	3226	3021	17.16
20	A"	3210	3007	25.68
21	A"	1552	1454	1.31
22	A"	1526	1429	0.94
23	A"	1239	1160	0.50
24	A"	1194	1118	0.01
25	A"	1150	1077	3.81
26	A"	1110	1039	1.31
27	A"	915	857	7.10
28	A"	850	796	4.28
29	A"	349	327	0.61
30	A"	237	222	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.348	0.405	0.000
C2	-0.883	1.274	0.000
H3	1.287	0.944	0.000
C4	0.348	-0.895	0.753
C5	0.348	-0.895	-0.753
H6	1.251	-1.197	1.264
H7	1.251	-1.197	-1.264
H8	-0.567	-1.180	1.255
H9	-0.567	-1.180	-1.255
H10	-1.781	0.656	0.000
H11	-0.917	1.913	0.883
H12	-0.917	1.913	-0.883

	C1	C2	H3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.5066	1.0835	1.5024	1.5024	2.2313	2.2313	2.2185	2.2185	2.1436	2.1569	2.1569
C2	1.5066		2.1951	2.6054	2.6054	3.5010	3.5010	2.7741	2.7741	1.0906	1.0904	1.0904
H3	1.0835	2.1951		2.1986	2.1986	2.4868	2.4868	3.0861	3.0861	3.0821	2.5642	2.5642
C4	1.5024	2.6054	2.1986		1.5057	1.0804	2.2299	1.0814	2.2246	2.7397	3.0822	3.4871
C5	1.5024	2.6054	2.1986	1.5057		2.2299	1.0804	2.2246	1.0814	2.7397	3.4871	3.0822
H6	2.2313	3.5010	2.4868	1.0804	2.2299		2.5270	1.8177	3.1059	3.7714	3.8097	4.3564
H7	2.2313	3.5010	2.4868	2.2299	1.0804	2.5270		3.1059	1.8177	3.7714	4.3564	3.8097
H8	2.2185	2.7741	3.0861	1.0814	2.2246	1.8177	3.1059		2.5100	2.5335	3.1340	3.7757
H9	2.2185	2.7741	3.0861	2.2246	1.0814	3.1059	1.8177	2.5100		2.5335	3.7757	3.1340
H10	2.1436	1.0906	3.0821	2.7397	2.7397	3.7714	3.7714	2.5335	2.5335		1.7626	1.7626
H11	2.1569	1.0904	2.5642	3.0822	3.4871	3.8097	4.3564	3.1340	3.7757	1.7626		1.7666
H12	2.1569	1.0904	2.5642	3.4871	3.0822	4.3564	3.8097	3.7757	3.1340	1.7626	1.7666

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H10	110.224	C1	C2	H11	111.297
C1	C2	H12	111.297	C1	C4	H5	59.927
C1	C4	H6	118.607	C1	C4	H8	117.392
C1	H5	C4	59.927	C1	H5	H7	118.607
C1	H5	H9	117.392	C2	C1	C3	114.898
C2	C1	C4	119.962	C2	C1	H5	119.962
C3	C1	C4	115.518	C3	C1	H5	115.518
C4	C1	H5	60.145	C4	H5	H7	118.207
C4	H5	H9	117.666	H5	C4	H6	118.207
H5	C4	H8	117.666	H6	C4	H8	114.450
H7	H5	H9	114.450	H10	C2	H11	107.839
H10	C2	H12	107.839	H11	C2	H12	108.207

All results from a given calculation for C₄H₈ (methylcyclopropane)

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

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 C4H8 (methylcyclopropane)

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

States and conformations

All results from a given calculation for C₄H₈ (methylcyclopropane)