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	hartrees
Energy at 0K	-156.804321
Energy at 298.15K	-156.812924
HF Energy	-156.133563
Nuclear repulsion energy	123.722529

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3239	3141
2	A'	3157	3061
3	A'	3143	3047
4	A'	3107	3013
5	A'	3029	2937
6	A'	1528	1482
7	A'	1513	1467
8	A'	1440	1396
9	A'	1401	1359
10	A'	1241	1204
11	A'	1221	1184
12	A'	1076	1043
13	A'	1010	979
14	A'	949	920
15	A'	803	779
16	A'	778	754
17	A'	361	350
18	A"	3225	3127
19	A"	3136	3041
20	A"	3106	3012
21	A"	1506	1461
22	A"	1479	1434
23	A"	1210	1173
24	A"	1159	1124
25	A"	1120	1086
26	A"	1081	1049
27	A"	881	855
28	A"	833	808
29	A"	341	330
30	A"	222	215

Atom	x (Å)	y (Å)	z (Å)
C1	0.350	0.409	0.000
C2	-0.890	1.281	0.000
H3	1.295	0.952	0.000
C4	0.350	-0.901	0.760
C5	0.350	-0.901	-0.760
H6	1.261	-1.204	1.270
H7	1.261	-1.204	-1.270
H8	-0.572	-1.186	1.262
H9	-0.572	-1.186	-1.262
H10	-1.792	0.654	0.000
H11	-0.923	1.923	0.890
H12	-0.923	1.923	-0.890

	C1	C2	H3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.5160	1.0899	1.5144	1.5144	2.2461	2.2461	2.2335	2.2335	2.1567	2.1693	2.1693
C2	1.5160		2.2098	2.6221	2.6221	3.5237	3.5237	2.7892	2.7892	1.0984	1.0983	1.0983
H3	1.0899	2.2098		2.2145	2.2145	2.5027	2.5027	3.1068	3.1068	3.1019	2.5795	2.5795
C4	1.5144	2.6221	2.2145		1.5205	1.0871	2.2455	1.0882	2.2412	2.7546	3.1005	3.5099
C5	1.5144	2.6221	2.2145	1.5205		2.2455	1.0871	2.2412	1.0882	2.7546	3.5099	3.1005
H6	2.2461	3.5237	2.5027	1.0871	2.2455		2.5391	1.8335	3.1261	3.7938	3.8336	4.3837
H7	2.2461	3.5237	2.5027	2.2455	1.0871	2.5391		3.1261	1.8335	3.7938	4.3837	3.8336
H8	2.2335	2.7892	3.1068	1.0882	2.2412	1.8335	3.1261		2.5248	2.5437	3.1512	3.7980
H9	2.2335	2.7892	3.1068	2.2412	1.0882	3.1261	1.8335	2.5248		2.5437	3.7980	3.1512
H10	2.1567	1.0984	3.1019	2.7546	2.7546	3.7938	3.7938	2.5437	2.5437		1.7774	1.7774
H11	2.1693	1.0983	2.5795	3.1005	3.5099	3.8336	4.3837	3.1512	3.7980	1.7774		1.7801
H12	2.1693	1.0983	2.5795	3.5099	3.1005	4.3837	3.8336	3.7980	3.1512	1.7774	1.7801

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H10	110.138	C1	C2	H11	111.142
C1	C2	H12	111.142	C1	C4	H5	59.867
C1	C4	H6	118.476	C1	C4	H8	117.282
C1	H5	C4	59.867	C1	H5	H7	118.476
C1	H5	H9	117.282	C2	C1	C3	115.009
C2	C1	C4	119.823	C2	C1	H5	119.823
C3	C1	C4	115.530	C3	C1	H5	115.530
C4	C1	H5	60.266	C4	H5	H7	117.938
C4	H5	H9	117.482	H5	C4	H6	117.938
H5	C4	H8	117.482	H6	C4	H8	114.892
H7	H5	H9	114.892	H10	C2	H11	108.018
H10	C2	H12	108.018	H11	C2	H12	108.268

All results from a given calculation for C₄H₈ (methylcyclopropane)

using model chemistry: MP4/6-311G**

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: MP4/6-311G**

States and conformations

All results from a given calculation for C₄H₈ (methylcyclopropane)