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	hartrees
Energy at 0K	-194.632403
Energy at 298.15K	-194.641073
HF Energy	-193.948182
Nuclear repulsion energy	170.260567

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3161	3004	0.00
2	A₁	1526	1450	0.00
3	A₁	1102	1047	0.00
4	A₁	1072	1019	0.00
5	A₁	613	582	0.00
6	A₂	3250	3088	0.00
7	A₂	1191	1132	0.00
8	A₂	858	815	0.00
9	B₁	3249	3087	0.00
10	B₁	1202	1142	0.00
11	B₁	1044	992	0.00
12	B₁	299	284	0.00
13	B₂	3163	3006	27.15
14	B₂	1626	1545	1.31
15	B₂	1465	1392	0.37
16	B₂	1032	980	22.05
17	B₂	926	880	18.96
18	E	3262	3099	18.78
18	E	3262	3099	18.78
19	E	3158	3001	18.99
19	E	3158	3001	18.99
20	E	1491	1417	2.16
20	E	1491	1417	2.16
21	E	1205	1145	1.72
21	E	1205	1145	1.72
22	E	1078	1024	2.90
22	E	1078	1024	2.90
23	E	913	868	5.64
23	E	913	868	5.64
24	E	803	763	0.45
24	E	803	763	0.45
25	E	304	289	0.39
25	E	304	289	0.39

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
C2	0.000	0.764	1.270
C3	0.000	-0.764	1.270
C4	-0.764	0.000	-1.270
C5	0.764	0.000	-1.270
H6	0.915	1.267	1.572
H7	-0.915	1.267	1.572
H8	-0.915	-1.267	1.572
H9	0.915	-1.267	1.572
H10	-1.267	-0.915	-1.572
H11	-1.267	0.915	-1.572
H12	1.267	0.915	-1.572
H13	1.267	-0.915	-1.572

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4822	1.4822	1.4822	1.4822	2.2160	2.2160	2.2160	2.2160	2.2160	2.2160	2.2160	2.2160
C2	1.4822		1.5284	2.7603	2.7603	1.0863	1.0863	2.2476	2.2476	3.5351	3.1147	3.1147	3.5351
C3	1.4822	1.5284		2.7603	2.7603	2.2476	2.2476	1.0863	1.0863	3.1147	3.5351	3.5351	3.1147
C4	1.4822	2.7603	2.7603		1.5284	3.5351	3.1147	3.1147	3.5351	1.0863	1.0863	2.2476	2.2476
C5	1.4822	2.7603	2.7603	1.5284		3.1147	3.5351	3.5351	3.1147	2.2476	2.2476	1.0863	1.0863
H6	2.2160	1.0863	2.2476	3.5351	3.1147		1.8294	3.1247	2.5332	4.4040	3.8420	3.1822	3.8420
H7	2.2160	1.0863	2.2476	3.1147	3.5351	1.8294		2.5332	3.1247	3.8420	3.1822	3.8420	4.4040
H8	2.2160	2.2476	1.0863	3.1147	3.5351	3.1247	2.5332		1.8294	3.1822	3.8420	4.4040	3.8420
H9	2.2160	2.2476	1.0863	3.5351	3.1147	2.5332	3.1247	1.8294		3.8420	4.4040	3.8420	3.1822
H10	2.2160	3.5351	3.1147	1.0863	2.2476	4.4040	3.8420	3.1822	3.8420		1.8294	3.1247	2.5332
H11	2.2160	3.1147	3.5351	1.0863	2.2476	3.8420	3.1822	3.8420	4.4040	1.8294		2.5332	3.1247
H12	2.2160	3.1147	3.5351	2.2476	1.0863	3.1822	3.8420	4.4040	3.8420	3.1247	2.5332		1.8294
H13	2.2160	3.5351	3.1147	2.2476	1.0863	3.8420	4.4040	3.8420	3.1822	2.5332	3.1247	1.8294

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	58.962	C1	C2	H6	118.445
C1	C2	H7	118.445	C1	C3	C2	58.962
C1	C3	H8	118.445	C1	C3	H9	118.445
C1	C4	C5	58.962	C1	C4	H10	118.445
C1	C4	H11	118.445	C1	C5	C4	58.962
C1	C5	H12	118.445	C1	C5	H13	118.445
C2	C1	C3	62.076	C2	C1	C4	137.236
C2	C1	C5	137.236	C2	C3	H8	117.547
C2	C3	H9	117.547	C3	C1	C4	137.236
C3	C1	C5	137.236	C3	C2	H6	117.547
C3	C2	H7	117.547	C4	C1	C5	62.076
C4	C5	H12	117.547	C4	C5	H13	117.547
C5	C4	H10	117.547	C5	C4	H11	117.547
H6	C2	H7	114.715	H8	C3	H9	114.715
H10	C4	H11	114.715	H12	C5	H13	114.715

All results from a given calculation for C₅H₈ (Spiropentane)

using model chemistry: MP2/6-311G*

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 C5H8 (Spiropentane)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for C₅H₈ (Spiropentane)