CCCBDB calculation results Page

State	Conformation	minimum conformation	conformer description	state description
1	1	yes	IH	¹A_G

	hartrees
Energy at 0K	-2272.184190
Energy at 298.15K	-2272.185877
HF Energy	-2272.184190
Nuclear repulsion energy	8396.355529

Vibrational Frequencies calculated at HF/6-311G**

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A_g	1591	1446	0.00	726.24	0.00	0.00
2	A_g	525	477	0.00	106.45	0.00	0.00
3	A_u	1062	964	0.00	0.00	0.00	0.00
4	T_1g	1398	1270	0.00	0.00	0.00	0.00
4	T_1g	1398	1270	0.00	0.00	0.00	0.00
4	T_1g	1398	1270	0.00	0.00	0.00	0.00
5	T_1g	916	832	0.00	0.00	0.00	0.00
5	T_1g	916	832	0.00	0.00	0.00	0.00
5	T_1g	916	832	0.00	0.00	0.00	0.00
6	T_1g	641	583	0.00	0.00	0.00	0.00
6	T_1g	641	583	0.00	0.00	0.00	0.00
6	T_1g	641	583	0.00	0.00	0.00	0.00
7	T_1u	1539	1398	20.34	0.00	0.00	0.00
7	T_1u	1539	1398	20.34	0.00	0.00	0.00
7	T_1u	1539	1398	20.34	0.00	0.00	0.00
8	T_1u	1291	1173	10.71	0.00	0.00	0.00
8	T_1u	1291	1173	10.71	0.00	0.00	0.00
8	T_1u	1291	1173	10.71	0.00	0.00	0.00
9	T_1u	622	565	11.17	0.00	0.00	0.00
9	T_1u	622	565	11.17	0.00	0.00	0.00
9	T_1u	622	565	11.17	0.00	0.00	0.00
10	T_1u	600	545	47.55	0.00	0.00	0.00
10	T_1u	600	545	47.55	0.00	0.00	0.00
10	T_1u	600	545	47.55	0.00	0.00	0.00
11	T_2g	1503	1365	0.00	0.00	0.00	0.00
11	T_2g	1503	1365	0.00	0.00	0.00	0.00
11	T_2g	1503	1365	0.00	0.00	0.00	0.00
12	T_2g	869	790	0.00	0.00	0.00	0.00
12	T_2g	869	790	0.00	0.00	0.00	0.00
12	T_2g	869	790	0.00	0.00	0.00	0.00
13	T_2g	726	659	0.00	0.00	0.00	0.00
13	T_2g	726	659	0.00	0.00	0.00	0.00
13	T_2g	726	659	0.00	0.00	0.00	0.00
14	T_2g	613	557	0.00	0.00	0.00	0.00
14	T_2g	613	557	0.00	0.00	0.00	0.00
14	T_2g	613	557	0.00	0.00	0.00	0.00
15	T_2u	1705	1549	0.00	0.00	0.00	0.00
15	T_2u	1705	1549	0.00	0.00	0.00	0.00
15	T_2u	1705	1549	0.00	0.00	0.00	0.00
16	T_2u	1251	1137	0.00	0.00	0.00	0.00
16	T_2u	1251	1137	0.00	0.00	0.00	0.00
16	T_2u	1251	1137	0.00	0.00	0.00	0.00
17	T_2u	1009	917	0.00	0.00	0.00	0.00
17	T_2u	1009	917	0.00	0.00	0.00	0.00
17	T_2u	1009	917	0.00	0.00	0.00	0.00
18	T_2u	801	728	0.00	0.00	0.00	0.00
18	T_2u	801	728	0.00	0.00	0.00	0.00
18	T_2u	801	728	0.00	0.00	0.00	0.00
19	T_2u	372	338	0.00	0.00	0.00	0.00
19	T_2u	372	338	0.00	0.00	0.00	0.00
19	T_2u	372	338	0.00	0.00	0.00	0.00
20	G_g	1678	1524	0.00	0.00	0.00	0.00
20	G_g	1678	1524	0.00	0.00	0.00	0.00
20	G_g	1678	1524	0.00	0.00	0.00	0.00
20	G_g	1678	1524	0.00	0.00	0.00	0.00
21	G_g	1434	1303	0.00	0.00	0.00	0.00
21	G_g	1434	1303	0.00	0.00	0.00	0.00
21	G_g	1434	1303	0.00	0.00	0.00	0.00
21	G_g	1434	1303	0.00	0.00	0.00	0.00
22	G_g	1124	1021	0.00	0.00	0.00	0.00
22	G_g	1124	1021	0.00	0.00	0.00	0.00
22	G_g	1124	1021	0.00	0.00	0.00	0.00
22	G_g	1124	1021	0.00	0.00	0.00	0.00
23	G_g	836	760	0.00	0.00	0.00	0.00
23	G_g	836	760	0.00	0.00	0.00	0.00
23	G_g	836	760	0.00	0.00	0.00	0.00
23	G_g	836	760	0.00	0.00	0.00	0.00
24	G_g	619	562	0.00	0.00	0.00	0.00
24	G_g	619	562	0.00	0.00	0.00	0.00
24	G_g	619	562	0.00	0.00	0.00	0.00
24	G_g	619	562	0.00	0.00	0.00	0.00
25	G_g	536	487	0.00	0.00	0.00	0.00
25	G_g	536	487	0.00	0.00	0.00	0.00
25	G_g	536	487	0.00	0.00	0.00	0.00
25	G_g	536	487	0.00	0.00	0.00	0.00
26	G_u	1587	1442	0.00	0.00	0.00	0.00
26	G_u	1587	1442	0.00	0.00	0.00	0.00
26	G_u	1587	1442	0.00	0.00	0.00	0.00
26	G_u	1587	1442	0.00	0.00	0.00	0.00
27	G_u	1428	1298	0.00	0.00	0.00	0.00
27	G_u	1428	1298	0.00	0.00	0.00	0.00
27	G_u	1428	1298	0.00	0.00	0.00	0.00
27	G_u	1428	1298	0.00	0.00	0.00	0.00
28	G_u	1045	949	0.00	0.00	0.00	0.00
28	G_u	1045	949	0.00	0.00	0.00	0.00
28	G_u	1045	949	0.00	0.00	0.00	0.00
28	G_u	1045	949	0.00	0.00	0.00	0.00
29	G_u	826	750	0.00	0.00	0.00	0.00
29	G_u	826	750	0.00	0.00	0.00	0.00
29	G_u	826	750	0.00	0.00	0.00	0.00
29	G_u	826	750	0.00	0.00	0.00	0.00
30	G_u	782	710	0.00	0.00	0.00	0.00
30	G_u	782	710	0.00	0.00	0.00	0.00
30	G_u	782	710	0.00	0.00	0.00	0.00
30	G_u	782	710	0.00	0.00	0.00	0.00
31	G_u	390	354	0.00	0.00	0.00	0.00
31	G_u	390	354	0.00	0.00	0.00	0.00
31	G_u	390	354	0.00	0.00	0.00	0.00
31	G_u	390	354	0.00	0.00	0.00	0.00
32	H_g	1783	1620	0.00	51.30	0.75	0.86
32	H_g	1783	1620	0.00	51.30	0.75	0.86
32	H_g	1783	1620	0.00	51.30	0.75	0.86
32	H_g	1783	1620	0.00	51.30	0.75	0.86
32	H_g	1783	1620	0.00	51.30	0.75	0.86
33	H_g	1552	1410	0.00	3.03	0.75	0.86
33	H_g	1552	1410	0.00	3.03	0.75	0.86
33	H_g	1552	1410	0.00	3.03	0.75	0.86
33	H_g	1552	1410	0.00	3.03	0.75	0.86
33	H_g	1552	1410	0.00	3.03	0.75	0.86
34	H_g	1371	1245	0.00	37.13	0.75	0.86
34	H_g	1371	1245	0.00	37.13	0.75	0.86
34	H_g	1371	1245	0.00	37.13	0.75	0.86
34	H_g	1371	1245	0.00	37.13	0.75	0.86
34	H_g	1371	1245	0.00	37.13	0.75	0.86
35	H_g	1203	1093	0.00	18.92	0.75	0.86
35	H_g	1203	1093	0.00	18.92	0.75	0.86
35	H_g	1203	1093	0.00	18.92	0.75	0.86
35	H_g	1203	1093	0.00	18.92	0.75	0.86
35	H_g	1203	1093	0.00	18.92	0.75	0.86
36	H_g	837	760	0.00	8.87	0.75	0.86
36	H_g	837	760	0.00	8.87	0.75	0.86
36	H_g	837	760	0.00	8.87	0.75	0.86
36	H_g	837	760	0.00	8.87	0.75	0.86
36	H_g	837	760	0.00	8.87	0.75	0.86
37	H_g	795	722	0.00	0.97	0.75	0.86
37	H_g	795	722	0.00	0.97	0.75	0.86
37	H_g	795	722	0.00	0.97	0.75	0.86
37	H_g	795	722	0.00	0.97	0.75	0.86
37	H_g	795	722	0.00	0.97	0.75	0.86
38	H_g	482	438	0.00	2.14	0.75	0.86
38	H_g	482	438	0.00	2.14	0.75	0.86
38	H_g	482	438	0.00	2.14	0.75	0.86
38	H_g	482	438	0.00	2.14	0.75	0.86
38	H_g	482	438	0.00	2.14	0.75	0.86
39	H_g	289	262	0.00	19.76	0.75	0.86
39	H_g	289	262	0.00	19.76	0.75	0.86
39	H_g	289	262	0.00	19.76	0.75	0.86
39	H_g	289	262	0.00	19.76	0.75	0.86
39	H_g	289	262	0.00	19.76	0.75	0.86
40	H_u	1775	1613	0.00	0.00	0.00	0.00
40	H_u	1775	1613	0.00	0.00	0.00	0.00
40	H_u	1775	1613	0.00	0.00	0.00	0.00
40	H_u	1775	1613	0.00	0.00	0.00	0.00
40	H_u	1775	1613	0.00	0.00	0.00	0.00
41	H_u	1484	1348	0.00	0.00	0.00	0.00
41	H_u	1484	1348	0.00	0.00	0.00	0.00
41	H_u	1484	1348	0.00	0.00	0.00	0.00
41	H_u	1484	1348	0.00	0.00	0.00	0.00
41	H_u	1484	1348	0.00	0.00	0.00	0.00
42	H_u	1347	1224	0.00	0.00	0.00	0.00
42	H_u	1347	1224	0.00	0.00	0.00	0.00
42	H_u	1347	1224	0.00	0.00	0.00	0.00
42	H_u	1347	1224	0.00	0.00	0.00	0.00
42	H_u	1347	1224	0.00	0.00	0.00	0.00
43	H_u	824	748	0.00	0.00	0.00	0.00
43	H_u	824	748	0.00	0.00	0.00	0.00
43	H_u	824	748	0.00	0.00	0.00	0.00
43	H_u	824	748	0.00	0.00	0.00	0.00
43	H_u	824	748	0.00	0.00	0.00	0.00
44	H_u	737	670	0.00	0.00	0.00	0.00
44	H_u	737	670	0.00	0.00	0.00	0.00
44	H_u	737	670	0.00	0.00	0.00	0.00
44	H_u	737	670	0.00	0.00	0.00	0.00
44	H_u	737	670	0.00	0.00	0.00	0.00
45	H_u	596	541	0.00	0.00	0.00	0.00
45	H_u	596	541	0.00	0.00	0.00	0.00
45	H_u	596	541	0.00	0.00	0.00	0.00
45	H_u	596	541	0.00	0.00	0.00	0.00
45	H_u	596	541	0.00	0.00	0.00	0.00
46	H_u	441	401	0.00	0.00	0.00	0.00
46	H_u	441	401	0.00	0.00	0.00	0.00
46	H_u	441	401	0.00	0.00	0.00	0.00
46	H_u	441	401	0.00	0.00	0.00	0.00
46	H_u	441	401	0.00	0.00	0.00	0.00

Unscaled Zero Point Vibrational Energy (zpe) 88727.7 cm^-1
Scaled (by 0.9085) Zero Point Vibrational Energy (zpe) 80609.1 cm^-1
See section III.C.1 List or set vibrational scaling factors to change the scale factors used here.
See section III.C.2 Calculate a vibrational scaling factor for a given set of molecules to determine the least squares best scaling factor.

A	B	C
0.00283	0.00283	0.00283

Geometric Data calculated at HF/6-311G**

Point Group is I_h

Cartesians (Å)

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.232	3.298
C2	-1.172	0.381	3.298
C3	-0.724	-0.997	3.298
C4	0.724	-0.997	3.298
C5	1.172	0.381	3.298
C6	2.281	0.741	2.577
C7	3.005	-0.255	1.815
C8	2.582	-1.560	1.815
C9	1.410	-1.941	2.577
C10	0.686	-2.937	1.815
C11	-0.686	-2.937	1.815
C12	-1.410	-1.941	2.577
C13	-2.582	-1.560	1.815
C14	-3.005	-0.255	1.815
C15	-2.281	0.741	2.577
C16	-2.281	1.973	1.815
C17	-3.005	1.738	0.583
C18	-3.453	0.361	0.583
C19	-3.453	-0.361	-0.583
C20	-3.005	-1.738	-0.583
C21	-2.582	-2.321	0.583
C22	-1.410	-3.173	0.583
C23	-0.724	-3.395	-0.583
C24	0.724	-3.395	-0.583
C25	1.410	-3.173	0.583
C26	2.582	-2.321	0.583
C27	3.005	-1.738	-0.583
C28	3.453	-0.361	-0.583
C29	3.453	0.361	0.583
C30	3.005	1.738	0.583
C31	2.582	2.321	-0.583
C32	2.582	1.560	-1.815
C33	3.005	0.255	-1.815
C34	2.281	-0.741	-2.577
C35	2.281	-1.973	-1.815
C36	1.172	-2.779	-1.815
C37	0.000	-2.399	-2.577
C38	-1.172	-2.779	-1.815
C39	-2.281	-1.973	-1.815
C40	-2.281	-0.741	-2.577
C41	-3.005	0.255	-1.815
C42	-2.582	1.560	-1.815
C43	-2.582	2.321	-0.583
C44	-1.410	3.173	-0.583
C45	-0.686	2.937	-1.815
C46	-1.410	1.941	-2.577
C47	-0.724	0.997	-3.298
C48	-1.172	-0.381	-3.298
C49	0.000	-1.232	-3.298
C50	1.172	-0.381	-3.298
C51	0.724	0.997	-3.298
C52	1.410	1.941	-2.577
C53	0.686	2.937	-1.815
C54	1.410	3.173	-0.583
C55	0.724	3.395	0.583
C56	-0.724	3.395	0.583
C57	-1.172	2.779	1.815
C58	0.000	2.399	2.577
C59	1.172	2.779	1.815
C60	2.281	1.973	1.815

Atom - Atom Distances (Å)

	C1	C2	C3	C4	C5	C6	C7	C8	C9	C10	C11	C12	C13	C14	C15	C16	C17	C18	C19	C20	C21	C22	C23	C24	C25	C26	C27	C28	C29	C30	C31	C32	C33	C34	C35	C36	C37	C38	C39	C40	C41	C42	C43	C44	C45	C46	C47	C48	C49	C50	C51	C52	C53	C54	C55	C56	C57	C58	C59	C60
C1		1.4482	2.3433	2.3433	1.4482	2.4424	3.6665	4.0813	3.5459	4.4778	4.4778	3.5459	4.0813	3.6665	2.4424	2.8199	4.0813	4.4778	5.4336	5.7374	5.1632	5.3625	6.0829	6.0829	5.3625	5.1632	5.7374	5.4336	4.4778	4.0813	4.7871	5.7374	6.0110	6.6037	6.4516	6.6037	6.9060	6.6037	6.4516	6.6037	6.0110	5.7374	4.7871	4.5627	5.4336	6.0829	6.6396	6.8904	7.0409	6.8904	6.6396	6.0829	5.4336	4.5627	3.5459	3.5459	2.4424	1.3717	2.4424	2.8199
C2	1.4482		1.4482	2.3433	2.3433	3.5459	4.4778	4.4778	3.5459	4.0813	3.6665	2.4424	2.8199	2.4424	1.3717	2.4424	3.5459	3.5459	4.5627	4.7871	4.0813	4.4778	5.4336	5.7374	5.1632	5.3625	6.0829	6.0829	5.3625	5.1632	5.7374	6.4516	6.6037	6.9060	6.6037	6.4516	6.6037	6.0110	5.7374	6.0829	5.4336	5.4336	4.5627	4.7871	5.7374	6.0829	6.6396	6.6396	6.8904	7.0409	6.8904	6.6037	6.0110	5.4336	4.4778	4.0813	2.8199	2.4424	3.6665	4.0813
C3	2.3433	1.4482		1.4483	2.3433	3.5459	4.0813	3.6665	2.4424	2.8199	2.4424	1.3717	2.4424	2.8199	2.4424	3.6665	4.4778	4.0813	4.7871	4.5627	3.5459	3.5459	4.5627	4.7871	4.0813	4.4778	5.4336	5.7374	5.1632	5.3625	6.0829	6.6037	6.4516	6.6037	6.0110	5.7374	6.0829	5.4336	5.4336	6.0829	5.7374	6.0110	5.4336	5.7374	6.4516	6.6037	6.8904	6.6396	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	5.3625	5.1632	4.0813	3.5459	4.4778	4.4778
C4	2.3433	2.3433	1.4483		1.4482	2.4424	2.8199	2.4424	1.3717	2.4424	2.8199	2.4424	3.6665	4.0813	3.5459	4.4778	5.3625	5.1632	5.7374	5.4336	4.4778	4.0813	4.7871	4.5627	3.5459	3.5459	4.5627	4.7871	4.0813	4.4778	5.4336	6.0110	5.7374	6.0829	5.4336	5.4336	6.0829	5.7374	6.0110	6.6037	6.4516	6.6037	6.0829	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.6396	6.8904	6.6037	6.4516	5.7374	5.1632	5.3625	4.4778	3.5459	4.0813	3.6665
C5	1.4482	2.3433	2.3433	1.4482		1.3717	2.4424	2.8199	2.4424	3.6665	4.0813	3.5459	4.4778	4.4778	3.5459	4.0813	5.1632	5.3625	6.0829	6.0829	5.3625	5.1632	5.7374	5.4336	4.4778	4.0813	4.7871	4.5627	3.5459	3.5459	4.5627	5.4336	5.4336	6.0829	5.7374	6.0110	6.6037	6.4516	6.6037	6.9060	6.6037	6.4516	5.7374	5.4336	6.0110	6.6037	6.8904	7.0409	6.8904	6.6396	6.6396	6.0829	5.7374	4.7871	4.0813	4.4778	3.6665	2.4424	2.8199	2.4424
C6	2.4424	3.5459	3.5459	2.4424	1.3717		1.4482	2.4424	2.8199	4.0813	4.7871	4.5627	5.4336	5.4336	4.5627	4.7871	5.7374	6.0829	6.6396	6.6396	6.0829	5.7374	6.0110	5.4336	4.4778	3.6665	4.0813	3.5459	2.3433	2.3433	3.5459	4.4778	4.4778	5.3625	5.1632	5.7374	6.4516	6.6037	6.8904	7.0409	6.8904	6.6037	6.0110	5.4336	5.7374	6.4516	6.6037	6.9060	6.6037	6.0829	6.0829	5.3625	5.1632	4.0813	3.6665	4.4778	4.0813	2.8199	2.4424	1.4482
C7	3.6665	4.4778	4.0813	2.8199	2.4424	1.4482		1.3717	2.4424	3.5459	4.5627	4.7871	5.7374	6.0110	5.4336	5.7374	6.4516	6.6037	6.8904	6.6396	6.0829	5.4336	5.4336	4.5627	3.5459	2.4424	2.8199	2.4424	1.4482	2.3433	3.5459	4.0813	3.6665	4.4778	4.0813	4.7871	5.7374	6.0829	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	6.0829	6.6037	6.4516	6.6037	6.0110	5.4336	5.7374	5.1632	5.3625	4.4778	4.4778	5.3625	5.1632	4.0813	3.5459	2.3433
C8	4.0813	4.4778	3.6665	2.4424	2.8199	2.4424	1.3717		1.4482	2.3433	3.5459	4.0813	5.1632	5.7374	5.4336	6.0110	6.6037	6.4516	6.6037	6.0829	5.3625	4.4778	4.4778	3.5459	2.3433	1.4482	2.4424	2.8199	2.4424	3.5459	4.5627	4.7871	4.0813	4.4778	3.6665	4.0813	5.1632	5.3625	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.6396	6.8904	6.6037	6.4516	5.7374	5.4336	6.0110	5.7374	6.0829	5.4336	5.4336	6.0829	5.7374	4.7871	4.5627	3.5459
C9	3.5459	3.5459	2.4424	1.3717	2.4424	2.8199	2.4424	1.4482		1.4482	2.4424	2.8199	4.0813	4.7871	4.5627	5.4336	6.0829	5.7374	6.0110	5.4336	4.4778	3.6665	4.0813	3.5459	2.3433	2.3433	3.5459	4.0813	3.6665	4.4778	5.4336	5.7374	5.1632	5.3625	4.4778	4.4778	5.3625	5.1632	5.7374	6.4516	6.6037	6.8904	6.6396	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	6.0829	6.6037	6.4516	6.6037	6.0110	5.7374	6.0829	5.4336	4.5627	4.7871	4.0813
C10	4.4778	4.0813	2.8199	2.4424	3.6665	4.0813	3.5459	2.3433	1.4482		1.3717	2.4424	3.5459	4.5627	4.7871	5.7374	6.0829	5.4336	5.4336	4.5627	3.5459	2.4424	2.8199	2.4424	1.4483	2.3433	3.5459	4.4778	4.4778	5.3625	6.0829	6.0829	5.3625	5.1632	4.0813	3.6665	4.4778	4.0813	4.7871	5.7374	6.0829	6.6396	6.6396	6.8904	7.0409	6.8904	6.6037	6.0110	5.4336	5.7374	6.4516	6.6037	6.9060	6.6037	6.4516	6.6037	6.0110	5.4336	5.7374	5.1632
C11	4.4778	3.6665	2.4424	2.8199	4.0813	4.7871	4.5627	3.5459	2.4424	1.3717		1.4482	2.3433	3.5459	4.0813	5.1632	5.3625	4.4778	4.4778	3.5459	2.3433	1.4483	2.4424	2.8199	2.4424	3.5459	4.5627	5.4336	5.4336	6.0829	6.6396	6.6396	6.0829	5.7374	4.7871	4.0813	4.4778	3.6665	4.0813	5.1632	5.3625	6.0829	6.0829	6.6037	6.9060	6.6037	6.4516	5.7374	5.4336	6.0110	6.6037	6.8904	7.0409	6.8904	6.6037	6.4516	5.7374	5.4336	6.0110	5.7374
C12	3.5459	2.4424	1.3717	2.4424	3.5459	4.5627	4.7871	4.0813	2.8199	2.4424	1.4482		1.4482	2.4424	2.8199	4.0813	4.4778	3.6665	4.0813	3.5459	2.3433	2.3433	3.5459	4.0813	3.6665	4.4778	5.4336	6.0110	5.7374	6.0829	6.6396	6.8904	6.6037	6.4516	5.7374	5.1632	5.3625	4.4778	4.4778	5.3625	5.1632	5.7374	5.4336	6.0110	6.6037	6.4516	6.6037	6.0829	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.0829	5.7374	4.7871	4.5627	5.4336	5.4336
C13	4.0813	2.8199	2.4424	3.6665	4.4778	5.4336	5.7374	5.1632	4.0813	3.5459	2.3433	1.4482		1.3717	2.4424	3.5459	3.5459	2.4424	2.8199	2.4424	1.4482	2.3433	3.5459	4.4778	4.4778	5.3625	6.0829	6.6037	6.4516	6.6037	6.8904	7.0409	6.9060	6.6037	6.0829	5.3625	5.1632	4.0813	3.6665	4.4778	4.0813	4.7871	4.5627	5.4336	6.0829	5.7374	6.0110	5.4336	5.7374	6.4516	6.6037	6.8904	6.6396	6.6396	6.0829	5.4336	4.5627	4.7871	5.7374	6.0110
C14	3.6665	2.4424	2.8199	4.0813	4.4778	5.4336	6.0110	5.7374	4.7871	4.5627	3.5459	2.4424	1.3717		1.4482	2.3433	2.3433	1.4482	2.4424	2.8199	2.4424	3.5459	4.5627	5.4336	5.4336	6.0829	6.6396	6.8904	6.6037	6.4516	6.6037	6.9060	7.0409	6.8904	6.6396	6.0829	5.7374	4.7871	4.0813	4.4778	3.6665	4.0813	3.5459	4.4778	5.3625	5.1632	5.7374	5.4336	6.0110	6.6037	6.4516	6.6037	6.0829	6.0829	5.3625	4.4778	3.5459	4.0813	5.1632	5.7374
C15	2.4424	1.3717	2.4424	3.5459	3.5459	4.5627	5.4336	5.4336	4.5627	4.7871	4.0813	2.8199	2.4424	1.4482		1.4482	2.3433	2.3433	3.5459	4.0813	3.6665	4.4778	5.4336	6.0110	5.7374	6.0829	6.6396	6.6396	6.0829	5.7374	6.0110	6.6037	6.8904	7.0409	6.8904	6.6037	6.4516	5.7374	5.1632	5.3625	4.4778	4.4778	3.5459	4.0813	5.1632	5.3625	6.0829	6.0829	6.6037	6.9060	6.6037	6.4516	5.7374	5.4336	4.4778	3.6665	2.4424	2.8199	4.0813	4.7871
C16	2.8199	2.4424	3.6665	4.4778	4.0813	4.7871	5.7374	6.0110	5.4336	5.7374	5.1632	4.0813	3.5459	2.3433	1.4482		1.4482	2.3433	3.5459	4.4778	4.4778	5.3625	6.0829	6.6037	6.4516	6.6037	6.8904	6.6396	6.0829	5.4336	5.4336	6.0829	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	5.3625	5.1632	4.0813	3.6665	2.4424	2.8199	4.0813	4.4778	5.4336	5.7374	6.4516	6.6037	6.0110	5.7374	4.7871	4.5627	3.5459	2.4424	1.3717	2.4424	3.5459	4.5627
C17	4.0813	3.5459	4.4778	5.3625	5.1632	5.7374	6.4516	6.6037	6.0829	6.0829	5.3625	4.4778	3.5459	2.3433	2.3433	1.4482		1.4482	2.4424	3.6665	4.0813	5.1632	5.7374	6.4516	6.6037	6.9060	7.0409	6.8904	6.6037	6.0110	5.7374	6.0829	6.6396	6.6396	6.8904	6.6037	6.0110	5.4336	4.4778	4.0813	2.8199	2.4424	1.3717	2.4424	3.5459	3.5459	4.5627	4.7871	5.7374	6.0829	5.4336	5.4336	4.5627	4.7871	4.0813	2.8199	2.4424	3.6665	4.4778	5.4336
C18	4.4778	3.5459	4.0813	5.1632	5.3625	6.0829	6.6037	6.4516	5.7374	5.4336	4.4778	3.6665	2.4424	1.4482	2.3433	2.3433	1.4482		1.3717	2.4424	2.8199	4.0813	4.7871	5.7374	6.0110	6.6037	6.8904	7.0409	6.9060	6.6037	6.4516	6.6037	6.8904	6.6396	6.6396	6.0829	5.4336	4.5627	3.5459	3.5459	2.4424	2.8199	2.4424	3.6665	4.4778	4.0813	4.7871	4.5627	5.4336	6.0829	5.7374	6.0110	5.4336	5.7374	5.1632	4.0813	3.5459	4.4778	5.3625	6.0829
C19	5.4336	4.5627	4.7871	5.7374	6.0829	6.6396	6.8904	6.6037	6.0110	5.4336	4.4778	4.0813	2.8199	2.4424	3.5459	3.5459	2.4424	1.3717		1.4482	2.4424	3.6665	4.0813	5.1632	5.7374	6.4516	6.6037	6.9060	7.0409	6.8904	6.6037	6.4516	6.6037	6.0829	6.0829	5.3625	4.4778	3.5459	2.3433	2.3433	1.4482	2.4424	2.8199	4.0813	4.4778	3.6665	4.0813	3.5459	4.4778	5.3625	5.1632	5.7374	5.4336	6.0110	5.7374	4.7871	4.5627	5.4336	6.0829	6.6396
C20	5.7374	4.7871	4.5627	5.4336	6.0829	6.6396	6.6396	6.0829	5.4336	4.5627	3.5459	3.5459	2.4424	2.8199	4.0813	4.4778	3.6665	2.4424	1.4482		1.3717	2.4424	2.8199	4.0813	4.7871	5.7374	6.0110	6.6037	6.8904	7.0409	6.9060	6.6037	6.4516	5.7374	5.4336	4.4778	3.6665	2.4424	1.4482	2.3433	2.3433	3.5459	4.0813	5.1632	5.3625	4.4778	4.4778	3.5459	4.0813	5.1632	5.3625	6.0829	6.0829	6.6037	6.4516	5.7374	5.4336	6.0110	6.6037	6.8904
C21	5.1632	4.0813	3.5459	4.4778	5.3625	6.0829	6.0829	5.3625	4.4778	3.5459	2.3433	2.3433	1.4482	2.4424	3.6665	4.4778	4.0813	2.8199	2.4424	1.3717		1.4482	2.4424	3.6665	4.0813	5.1632	5.7374	6.4516	6.6037	6.9060	7.0409	6.8904	6.6037	6.0110	5.4336	4.4778	4.0813	2.8199	2.4424	3.5459	3.5459	4.5627	4.7871	5.7374	6.0829	5.4336	5.4336	4.5627	4.7871	5.7374	6.0829	6.6396	6.6396	6.8904	6.6037	6.0110	5.4336	5.7374	6.4516	6.6037
C22	5.3625	4.4778	3.5459	4.0813	5.1632	5.7374	5.4336	4.4778	3.6665	2.4424	1.4483	2.3433	2.3433	3.5459	4.4778	5.3625	5.1632	4.0813	3.6665	2.4424	1.4482		1.3717	2.4424	2.8199	4.0813	4.7871	5.7374	6.0110	6.6037	6.8904	6.6396	6.0829	5.4336	4.5627	3.5459	3.5459	2.4424	2.8199	4.0813	4.4778	5.4336	5.7374	6.4516	6.6037	6.0110	5.7374	4.7871	4.5627	5.4336	6.0829	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	6.0829	6.6037	6.4516
C23	6.0829	5.4336	4.5627	4.7871	5.7374	6.0110	5.4336	4.4778	4.0813	2.8199	2.4424	3.5459	3.5459	4.5627	5.4336	6.0829	5.7374	4.7871	4.0813	2.8199	2.4424	1.3717		1.4483	2.4424	3.6665	4.0813	5.1632	5.7374	6.4516	6.6037	6.0829	5.3625	4.4778	3.5459	2.3433	2.3433	1.4482	2.4424	3.6665	4.4778	5.4336	6.0110	6.6037	6.4516	5.7374	5.1632	4.0813	3.5459	4.4778	5.3625	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.6396	6.8904	6.6037
C24	6.0829	5.7374	4.7871	4.5627	5.4336	5.4336	4.5627	3.5459	3.5459	2.4424	2.8199	4.0813	4.4778	5.4336	6.0110	6.6037	6.4516	5.7374	5.1632	4.0813	3.6665	2.4424	1.4483		1.3717	2.4424	2.8199	4.0813	4.7871	5.7374	6.0110	5.4336	4.4778	3.6665	2.4424	1.4482	2.3433	2.3433	3.5459	4.4778	5.3625	6.0829	6.6037	6.9060	6.6037	6.0829	5.3625	4.4778	3.5459	4.0813	5.1632	5.7374	6.4516	6.6037	6.8904	7.0409	6.8904	6.6396	6.6396	6.0829
C25	5.3625	5.1632	4.0813	3.5459	4.4778	4.4778	3.5459	2.3433	2.3433	1.4483	2.4424	3.6665	4.4778	5.4336	5.7374	6.4516	6.6037	6.0110	5.7374	4.7871	4.0813	2.8199	2.4424	1.3717		1.4482	2.4424	3.6665	4.0813	5.1632	5.7374	5.4336	4.4778	4.0813	2.8199	2.4424	3.5459	3.5459	4.5627	5.4336	6.0829	6.6396	6.8904	7.0409	6.8904	6.6396	6.0829	5.4336	4.5627	4.7871	5.7374	6.0110	6.6037	6.4516	6.6037	6.9060	6.6037	6.0829	6.0829	5.3625
C26	5.1632	5.3625	4.4778	3.5459	4.0813	3.6665	2.4424	1.4482	2.3433	2.3433	3.5459	4.4778	5.3625	6.0829	6.0829	6.6037	6.9060	6.6037	6.4516	5.7374	5.1632	4.0813	3.6665	2.4424	1.4482		1.3717	2.4424	2.8199	4.0813	4.7871	4.5627	3.5459	3.5459	2.4424	2.8199	4.0813	4.4778	5.4336	6.0110	6.6037	6.8904	7.0409	6.8904	6.6396	6.6396	6.0829	5.7374	4.7871	4.5627	5.4336	5.4336	6.0829	5.7374	6.0110	6.6037	6.4516	5.7374	5.4336	4.4778
C27	5.7374	6.0829	5.4336	4.5627	4.7871	4.0813	2.8199	2.4424	3.5459	3.5459	4.5627	5.4336	6.0829	6.6396	6.6396	6.8904	7.0409	6.8904	6.6037	6.0110	5.7374	4.7871	4.0813	2.8199	2.4424	1.3717		1.4482	2.4424	3.6665	4.0813	3.5459	2.3433	2.3433	1.4482	2.4424	3.6665	4.4778	5.4336	5.7374	6.4516	6.6037	6.9060	6.6037	6.0829	6.0829	5.3625	5.1632	4.0813	3.5459	4.4778	4.4778	5.3625	5.1632	5.7374	6.4516	6.6037	6.0110	5.4336	4.4778
C28	5.4336	6.0829	5.7374	4.7871	4.5627	3.5459	2.4424	2.8199	4.0813	4.4778	5.4336	6.0110	6.6037	6.8904	6.6396	6.6396	6.8904	7.0409	6.9060	6.6037	6.4516	5.7374	5.1632	4.0813	3.6665	2.4424	1.4482		1.3717	2.4424	2.8199	2.4424	1.4482	2.3433	2.3433	3.5459	4.4778	5.3625	6.0829	6.0829	6.6037	6.4516	6.6037	6.0110	5.4336	5.7374	5.1632	5.3625	4.4778	3.5459	4.0813	3.6665	4.4778	4.0813	4.7871	5.7374	6.0829	5.4336	4.5627	3.5459
C29	4.4778	5.3625	5.1632	4.0813	3.5459	2.3433	1.4482	2.4424	3.6665	4.4778	5.4336	5.7374	6.4516	6.6037	6.0829	6.0829	6.6037	6.9060	7.0409	6.8904	6.6037	6.0110	5.7374	4.7871	4.0813	2.8199	2.4424	1.3717		1.4482	2.4424	2.8199	2.4424	3.5459	3.5459	4.5627	5.4336	6.0829	6.6396	6.6396	6.8904	6.6037	6.4516	5.7374	5.4336	6.0110	5.7374	6.0829	5.4336	4.5627	4.7871	4.0813	4.4778	3.6665	4.0813	5.1632	5.3625	4.4778	3.5459	2.3433
C30	4.0813	5.1632	5.3625	4.4778	3.5459	2.3433	2.3433	3.5459	4.4778	5.3625	6.0829	6.0829	6.6037	6.4516	5.7374	5.4336	6.0110	6.6037	6.8904	7.0409	6.9060	6.6037	6.4516	5.7374	5.1632	4.0813	3.6665	2.4424	1.4482		1.3717	2.4424	2.8199	4.0813	4.4778	5.4336	6.0110	6.6037	6.8904	6.6396	6.6396	6.0829	5.7374	4.7871	4.5627	5.4336	5.4336	6.0829	5.7374	4.7871	4.5627	3.5459	3.5459	2.4424	2.8199	4.0813	4.4778	3.6665	2.4424	1.4482
C31	4.7871	5.7374	6.0829	5.4336	4.5627	3.5459	3.5459	4.5627	5.4336	6.0829	6.6396	6.6396	6.8904	6.6037	6.0110	5.4336	5.7374	6.4516	6.6037	6.9060	7.0409	6.8904	6.6037	6.0110	5.7374	4.7871	4.0813	2.8199	2.4424	1.3717		1.4482	2.4424	3.6665	4.4778	5.4336	5.7374	6.4516	6.6037	6.0829	6.0829	5.3625	5.1632	4.0813	3.5459	4.4778	4.4778	5.3625	5.1632	4.0813	3.5459	2.3433	2.3433	1.4482	2.4424	3.6665	4.4778	4.0813	2.8199	2.4424
C32	5.7374	6.4516	6.6037	6.0110	5.4336	4.4778	4.0813	4.7871	5.7374	6.0829	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	6.0829	6.6037	6.4516	6.6037	6.8904	6.6396	6.0829	5.4336	5.4336	4.5627	3.5459	2.4424	2.8199	2.4424	1.4482		1.3717	2.4424	3.5459	4.5627	4.7871	5.7374	6.0110	5.4336	5.7374	5.1632	5.3625	4.4778	3.5459	4.0813	3.6665	4.4778	4.0813	2.8199	2.4424	1.4482	2.3433	2.3433	3.5459	4.4778	5.3625	5.1632	4.0813	3.6665
C33	6.0110	6.6037	6.4516	5.7374	5.4336	4.4778	3.6665	4.0813	5.1632	5.3625	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.6396	6.8904	6.6037	6.4516	6.6037	6.0829	5.3625	4.4778	4.4778	3.5459	2.3433	1.4482	2.4424	2.8199	2.4424	1.3717		1.4482	2.3433	3.5459	4.0813	5.1632	5.7374	5.4336	6.0110	5.7374	6.0829	5.4336	4.5627	4.7871	4.0813	4.4778	3.6665	2.4424	2.8199	2.4424	3.5459	3.5459	4.5627	5.4336	6.0829	5.7374	4.7871	4.0813
C34	6.6037	6.9060	6.6037	6.0829	6.0829	5.3625	4.4778	4.4778	5.3625	5.1632	5.7374	6.4516	6.6037	6.8904	7.0409	6.8904	6.6396	6.6396	6.0829	5.7374	6.0110	5.4336	4.4778	3.6665	4.0813	3.5459	2.3433	2.3433	3.5459	4.0813	3.6665	2.4424	1.4482		1.4482	2.4424	2.8199	4.0813	4.7871	4.5627	5.4336	5.4336	6.0829	5.7374	4.7871	4.5627	3.5459	3.5459	2.4424	1.3717	2.4424	2.8199	4.0813	4.4778	5.4336	6.0110	6.6037	6.4516	5.7374	5.1632
C35	6.4516	6.6037	6.0110	5.4336	5.7374	5.1632	4.0813	3.6665	4.4778	4.0813	4.7871	5.7374	6.0829	6.6396	6.8904	7.0409	6.8904	6.6396	6.0829	5.4336	5.4336	4.5627	3.5459	2.4424	2.8199	2.4424	1.4482	2.3433	3.5459	4.4778	4.4778	3.5459	2.3433	1.4482		1.3717	2.4424	3.5459	4.5627	4.7871	5.7374	6.0110	6.6037	6.4516	5.7374	5.4336	4.4778	4.0813	2.8199	2.4424	3.6665	4.0813	5.1632	5.3625	6.0829	6.6037	6.9060	6.6037	6.0829	5.3625
C36	6.6037	6.4516	5.7374	5.4336	6.0110	5.7374	4.7871	4.0813	4.4778	3.6665	4.0813	5.1632	5.3625	6.0829	6.6037	6.9060	6.6037	6.0829	5.3625	4.4778	4.4778	3.5459	2.3433	1.4482	2.4424	2.8199	2.4424	3.5459	4.5627	5.4336	5.4336	4.5627	3.5459	2.4424	1.3717		1.4482	2.3433	3.5459	4.0813	5.1632	5.7374	6.4516	6.6037	6.0110	5.4336	4.4778	3.6665	2.4424	2.8199	4.0813	4.7871	5.7374	6.0829	6.6396	6.8904	7.0409	6.8904	6.6396	6.0829
C37	6.9060	6.6037	6.0829	6.0829	6.6037	6.4516	5.7374	5.1632	5.3625	4.4778	4.4778	5.3625	5.1632	5.7374	6.4516	6.6037	6.0110	5.4336	4.4778	3.6665	4.0813	3.5459	2.3433	2.3433	3.5459	4.0813	3.6665	4.4778	5.4336	6.0110	5.7374	4.7871	4.0813	2.8199	2.4424	1.4482		1.4482	2.4424	2.8199	4.0813	4.7871	5.7374	6.0829	5.4336	4.5627	3.5459	2.4424	1.3717	2.4424	3.5459	4.5627	5.4336	6.0829	6.6396	6.6396	6.8904	7.0409	6.8904	6.6037
C38	6.6037	6.0110	5.4336	5.7374	6.4516	6.6037	6.0829	5.3625	5.1632	4.0813	3.6665	4.4778	4.0813	4.7871	5.7374	6.0829	5.4336	4.5627	3.5459	2.4424	2.8199	2.4424	1.4482	2.3433	3.5459	4.4778	4.4778	5.3625	6.0829	6.6037	6.4516	5.7374	5.1632	4.0813	3.5459	2.3433	1.4482		1.3717	2.4424	3.5459	4.5627	5.4336	6.0829	5.7374	4.7871	4.0813	2.8199	2.4424	3.6665	4.4778	5.4336	6.0110	6.6037	6.8904	6.6396	6.6396	6.8904	7.0409	6.9060
C39	6.4516	5.7374	5.4336	6.0110	6.6037	6.8904	6.6396	6.0829	5.7374	4.7871	4.0813	4.4778	3.6665	4.0813	5.1632	5.3625	4.4778	3.5459	2.3433	1.4482	2.4424	2.8199	2.4424	3.5459	4.5627	5.4336	5.4336	6.0829	6.6396	6.8904	6.6037	6.0110	5.7374	4.7871	4.5627	3.5459	2.4424	1.3717		1.4482	2.3433	3.5459	4.4778	5.3625	5.1632	4.0813	3.6665	2.4424	2.8199	4.0813	4.4778	5.4336	5.7374	6.4516	6.6037	6.0829	6.0829	6.6037	6.9060	7.0409
C40	6.6037	6.0829	6.0829	6.6037	6.9060	7.0409	6.8904	6.6037	6.4516	5.7374	5.1632	5.3625	4.4778	4.4778	5.3625	5.1632	4.0813	3.5459	2.3433	2.3433	3.5459	4.0813	3.6665	4.4778	5.4336	6.0110	5.7374	6.0829	6.6396	6.6396	6.0829	5.4336	5.4336	4.5627	4.7871	4.0813	2.8199	2.4424	1.4482		1.4482	2.4424	3.6665	4.4778	4.0813	2.8199	2.4424	1.3717	2.4424	3.5459	3.5459	4.5627	4.7871	5.7374	6.0110	5.4336	5.7374	6.4516	6.6037	6.8904
C41	6.0110	5.4336	5.7374	6.4516	6.6037	6.8904	7.0409	6.9060	6.6037	6.0829	5.3625	5.1632	4.0813	3.6665	4.4778	4.0813	2.8199	2.4424	1.4482	2.3433	3.5459	4.4778	4.4778	5.3625	6.0829	6.6037	6.4516	6.6037	6.8904	6.6396	6.0829	5.7374	6.0110	5.4336	5.7374	5.1632	4.0813	3.5459	2.3433	1.4482		1.3717	2.4424	3.5459	3.5459	2.4424	2.8199	2.4424	3.6665	4.4778	4.0813	4.7871	4.5627	5.4336	5.4336	4.5627	4.7871	5.7374	6.0829	6.6396
C42	5.7374	5.4336	6.0110	6.6037	6.4516	6.6037	6.9060	7.0409	6.8904	6.6396	6.0829	5.7374	4.7871	4.0813	4.4778	3.6665	2.4424	2.8199	2.4424	3.5459	4.5627	5.4336	5.4336	6.0829	6.6396	6.8904	6.6037	6.4516	6.6037	6.0829	5.3625	5.1632	5.7374	5.4336	6.0110	5.7374	4.7871	4.5627	3.5459	2.4424	1.3717		1.4482	2.3433	2.3433	1.4482	2.4424	2.8199	4.0813	4.4778	3.6665	4.0813	3.5459	4.4778	4.4778	3.5459	4.0813	5.1632	5.3625	6.0829
C43	4.7871	4.5627	5.4336	6.0829	5.7374	6.0110	6.6037	6.8904	6.6396	6.6396	6.0829	5.4336	4.5627	3.5459	3.5459	2.4424	1.3717	2.4424	2.8199	4.0813	4.7871	5.7374	6.0110	6.6037	6.8904	7.0409	6.9060	6.6037	6.4516	5.7374	5.1632	5.3625	6.0829	6.0829	6.6037	6.4516	5.7374	5.4336	4.4778	3.6665	2.4424	1.4482		1.4482	2.3433	2.3433	3.5459	4.0813	5.1632	5.3625	4.4778	4.4778	3.5459	4.0813	3.6665	2.4424	2.8199	4.0813	4.4778	5.4336
C44	4.5627	4.7871	5.7374	6.0829	5.4336	5.4336	6.0829	6.6396	6.6396	6.8904	6.6037	6.0110	5.4336	4.4778	4.0813	2.8199	2.4424	3.6665	4.0813	5.1632	5.7374	6.4516	6.6037	6.9060	7.0409	6.8904	6.6037	6.0110	5.7374	4.7871	4.0813	4.4778	5.4336	5.7374	6.4516	6.6037	6.0829	6.0829	5.3625	4.4778	3.5459	2.3433	1.4482		1.4483	2.3433	3.5459	4.4778	5.3625	5.1632	4.0813	3.6665	2.4424	2.8199	2.4424	1.3717	2.4424	3.5459	3.5459	4.5627
C45	5.4336	5.7374	6.4516	6.6037	6.0110	5.7374	6.0829	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	5.3625	5.1632	4.0813	3.5459	4.4778	4.4778	5.3625	6.0829	6.6037	6.4516	6.6037	6.8904	6.6396	6.0829	5.4336	5.4336	4.5627	3.5459	3.5459	4.5627	4.7871	5.7374	6.0110	5.4336	5.7374	5.1632	4.0813	3.5459	2.3433	2.3433	1.4483		1.4482	2.4424	3.6665	4.4778	4.0813	2.8199	2.4424	1.3717	2.4424	2.8199	2.4424	3.6665	4.4778	4.0813	4.7871
C46	6.0829	6.0829	6.6037	6.9060	6.6037	6.4516	6.6037	6.8904	7.0409	6.8904	6.6037	6.4516	5.7374	5.1632	5.3625	4.4778	3.5459	4.0813	3.6665	4.4778	5.4336	6.0110	5.7374	6.0829	6.6396	6.6396	6.0829	5.7374	6.0110	5.4336	4.4778	4.0813	4.7871	4.5627	5.4336	5.4336	4.5627	4.7871	4.0813	2.8199	2.4424	1.4482	2.3433	2.3433	1.4482		1.3717	2.4424	3.5459	3.5459	2.4424	2.8199	2.4424	3.6665	4.0813	3.5459	4.4778	5.3625	5.1632	5.7374
C47	6.6396	6.6396	6.8904	7.0409	6.8904	6.6037	6.4516	6.6037	6.9060	6.6037	6.4516	6.6037	6.0110	5.7374	6.0829	5.4336	4.5627	4.7871	4.0813	4.4778	5.4336	5.7374	5.1632	5.3625	6.0829	6.0829	5.3625	5.1632	5.7374	5.4336	4.4778	3.6665	4.0813	3.5459	4.4778	4.4778	3.5459	4.0813	3.6665	2.4424	2.8199	2.4424	3.5459	3.5459	2.4424	1.3717		1.4482	2.3433	2.3433	1.4483	2.4424	2.8199	4.0813	4.7871	4.5627	5.4336	6.0829	5.7374	6.0110
C48	6.8904	6.6396	6.6396	6.8904	7.0409	6.9060	6.6037	6.4516	6.6037	6.0110	5.7374	6.0829	5.4336	5.4336	6.0829	5.7374	4.7871	4.5627	3.5459	3.5459	4.5627	4.7871	4.0813	4.4778	5.4336	5.7374	5.1632	5.3625	6.0829	6.0829	5.3625	4.4778	4.4778	3.5459	4.0813	3.6665	2.4424	2.8199	2.4424	1.3717	2.4424	2.8199	4.0813	4.4778	3.6665	2.4424	1.4482		1.4482	2.3433	2.3433	3.5459	4.0813	5.1632	5.7374	5.4336	6.0110	6.6037	6.4516	6.6037
C49	7.0409	6.8904	6.6396	6.6396	6.8904	6.6037	6.0110	5.7374	6.0829	5.4336	5.4336	6.0829	5.7374	6.0110	6.6037	6.4516	5.7374	5.4336	4.4778	4.0813	4.7871	4.5627	3.5459	3.5459	4.5627	4.7871	4.0813	4.4778	5.4336	5.7374	5.1632	4.0813	3.6665	2.4424	2.8199	2.4424	1.3717	2.4424	2.8199	2.4424	3.6665	4.0813	5.1632	5.3625	4.4778	3.5459	2.3433	1.4482		1.4482	2.3433	3.5459	4.4778	5.3625	6.0829	6.0829	6.6037	6.9060	6.6037	6.4516
C50	6.8904	7.0409	6.8904	6.6396	6.6396	6.0829	5.4336	5.4336	6.0829	5.7374	6.0110	6.6037	6.4516	6.6037	6.9060	6.6037	6.0829	6.0829	5.3625	5.1632	5.7374	5.4336	4.4778	4.0813	4.7871	4.5627	3.5459	3.5459	4.5627	4.7871	4.0813	2.8199	2.4424	1.3717	2.4424	2.8199	2.4424	3.6665	4.0813	3.5459	4.4778	4.4778	5.3625	5.1632	4.0813	3.5459	2.3433	2.3433	1.4482		1.4482	2.4424	3.6665	4.4778	5.4336	5.7374	6.4516	6.6037	6.0110	5.7374
C51	6.6396	6.8904	7.0409	6.8904	6.6396	6.0829	5.7374	6.0110	6.6037	6.4516	6.6037	6.9060	6.6037	6.4516	6.6037	6.0110	5.4336	5.7374	5.1632	5.3625	6.0829	6.0829	5.3625	5.1632	5.7374	5.4336	4.4778	4.0813	4.7871	4.5627	3.5459	2.4424	2.8199	2.4424	3.6665	4.0813	3.5459	4.4778	4.4778	3.5459	4.0813	3.6665	4.4778	4.0813	2.8199	2.4424	1.4483	2.3433	2.3433	1.4482		1.3717	2.4424	3.5459	4.5627	4.7871	5.7374	6.0829	5.4336	5.4336
C52	6.0829	6.6037	6.9060	6.6037	6.0829	5.3625	5.1632	5.7374	6.4516	6.6037	6.8904	7.0409	6.8904	6.6037	6.4516	5.7374	5.4336	6.0110	5.7374	6.0829	6.6396	6.6396	6.0829	5.7374	6.0110	5.4336	4.4778	3.6665	4.0813	3.5459	2.3433	1.4482	2.4424	2.8199	4.0813	4.7871	4.5627	5.4336	5.4336	4.5627	4.7871	4.0813	4.4778	3.6665	2.4424	2.8199	2.4424	3.5459	3.5459	2.4424	1.3717		1.4482	2.3433	3.5459	4.0813	5.1632	5.3625	4.4778	4.4778
C53	5.4336	6.0110	6.6037	6.4516	5.7374	5.1632	5.3625	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.0829	5.7374	4.7871	4.5627	5.4336	5.4336	6.0829	6.6396	6.8904	6.6037	6.4516	6.6037	6.0829	5.3625	4.4778	4.4778	3.5459	2.3433	2.3433	3.5459	4.0813	5.1632	5.7374	5.4336	6.0110	5.7374	4.7871	4.5627	3.5459	3.5459	2.4424	1.3717	2.4424	2.8199	4.0813	4.4778	3.6665	2.4424	1.4482		1.4483	2.4424	2.8199	4.0813	4.4778	3.6665	4.0813
C54	4.5627	5.4336	6.0829	5.7374	4.7871	4.0813	4.4778	5.4336	6.0110	6.6037	6.8904	6.6396	6.6396	6.0829	5.4336	4.5627	4.7871	5.7374	6.0110	6.6037	6.8904	7.0409	6.9060	6.6037	6.4516	5.7374	5.1632	4.0813	3.6665	2.4424	1.4482	2.3433	3.5459	4.4778	5.3625	6.0829	6.0829	6.6037	6.4516	5.7374	5.4336	4.4778	4.0813	2.8199	2.4424	3.6665	4.0813	5.1632	5.3625	4.4778	3.5459	2.3433	1.4483		1.3717	2.4424	3.5459	3.5459	2.4424	2.8199
C55	3.5459	4.4778	5.3625	5.1632	4.0813	3.6665	4.4778	5.4336	5.7374	6.4516	6.6037	6.0829	6.0829	5.3625	4.4778	3.5459	4.0813	5.1632	5.7374	6.4516	6.6037	6.9060	7.0409	6.8904	6.6037	6.0110	5.7374	4.7871	4.0813	2.8199	2.4424	3.5459	4.5627	5.4336	6.0829	6.6396	6.6396	6.8904	6.6037	6.0110	5.4336	4.4778	3.6665	2.4424	2.8199	4.0813	4.7871	5.7374	6.0829	5.4336	4.5627	3.5459	2.4424	1.3717		1.4483	2.3433	2.3433	1.4482	2.4424
C56	3.5459	4.0813	5.1632	5.3625	4.4778	4.4778	5.3625	6.0829	6.0829	6.6037	6.4516	5.7374	5.4336	4.4778	3.6665	2.4424	2.8199	4.0813	4.7871	5.7374	6.0110	6.6037	6.8904	7.0409	6.9060	6.6037	6.4516	5.7374	5.1632	4.0813	3.6665	4.4778	5.4336	6.0110	6.6037	6.8904	6.6396	6.6396	6.0829	5.4336	4.5627	3.5459	2.4424	1.3717	2.4424	3.5459	4.5627	5.4336	6.0829	5.7374	4.7871	4.0813	2.8199	2.4424	1.4483		1.4482	2.3433	2.3433	3.5459
C57	2.4424	2.8199	4.0813	4.4778	3.6665	4.0813	5.1632	5.7374	5.4336	6.0110	5.7374	4.7871	4.5627	3.5459	2.4424	1.3717	2.4424	3.5459	4.5627	5.4336	5.4336	6.0829	6.6396	6.8904	6.6037	6.4516	6.6037	6.0829	5.3625	4.4778	4.4778	5.3625	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.0829	5.7374	4.7871	4.0813	2.8199	2.4424	3.6665	4.4778	5.4336	6.0110	6.6037	6.4516	5.7374	5.1632	4.0813	3.5459	2.3433	1.4482		1.4482	2.3433	3.5459
C58	1.3717	2.4424	3.5459	3.5459	2.4424	2.8199	4.0813	4.7871	4.5627	5.4336	5.4336	4.5627	4.7871	4.0813	2.8199	2.4424	3.6665	4.4778	5.4336	6.0110	5.7374	6.0829	6.6396	6.6396	6.0829	5.7374	6.0110	5.4336	4.4778	3.6665	4.0813	5.1632	5.7374	6.4516	6.6037	6.8904	7.0409	6.8904	6.6037	6.4516	5.7374	5.1632	4.0813	3.5459	4.4778	5.3625	6.0829	6.6037	6.9060	6.6037	6.0829	5.3625	4.4778	3.5459	2.3433	2.3433	1.4482		1.4482	2.4424
C59	2.4424	3.6665	4.4778	4.0813	2.8199	2.4424	3.5459	4.5627	4.7871	5.7374	6.0110	5.4336	5.7374	5.1632	4.0813	3.5459	4.4778	5.3625	6.0829	6.6037	6.4516	6.6037	6.8904	6.6396	6.0829	5.4336	5.4336	4.5627	3.5459	2.4424	2.8199	4.0813	4.7871	5.7374	6.0829	6.6396	6.8904	7.0409	6.9060	6.6037	6.0829	5.3625	4.4778	3.5459	4.0813	5.1632	5.7374	6.4516	6.6037	6.0110	5.4336	4.4778	3.6665	2.4424	1.4482	2.3433	2.3433	1.4482		1.3717
C60	2.8199	4.0813	4.4778	3.6665	2.4424	1.4482	2.3433	3.5459	4.0813	5.1632	5.7374	5.4336	6.0110	5.7374	4.7871	4.5627	5.4336	6.0829	6.6396	6.8904	6.6037	6.4516	6.6037	6.0829	5.3625	4.4778	4.4778	3.5459	2.3433	1.4482	2.4424	3.6665	4.0813	5.1632	5.3625	6.0829	6.6037	6.9060	7.0409	6.8904	6.6396	6.0829	5.4336	4.5627	4.7871	5.7374	6.0110	6.6037	6.4516	5.7374	5.4336	4.4778	4.0813	2.8199	2.4424	3.5459	3.5459	2.4424	1.3717

picture of Buckminsterfullerene state 1 conformation 1

More geometry information
Calculated Bond Angles

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	108.000	C1	C2	C15	120.000
C1	C5	C4	108.000	C1	C5	C6	120.000
C1	C58	C57	120.000	C1	C58	C59	120.000
C2	C1	C5	108.000	C2	C1	C58	120.000
C2	C3	C4	108.000	C2	C3	C12	120.000
C2	C15	C14	120.000	C2	C15	C16	120.000
C3	C2	C15	120.000	C3	C4	C5	108.000
C3	C4	C9	120.000	C3	C12	C11	120.000
C3	C12	C13	120.000	C4	C3	C12	120.000
C4	C5	C6	120.000	C4	C9	C8	120.000
C4	C9	C10	120.000	C5	C1	C58	120.000
C5	C4	C9	120.000	C5	C6	C7	120.000
C5	C6	C60	120.000	C6	C7	C8	120.000
C6	C7	C29	108.000	C6	C60	C30	108.000
C6	C60	C59	120.000	C7	C6	C60	108.000
C7	C8	C9	120.000	C7	C8	C26	120.000
C7	C29	C28	120.000	C7	C29	C30	108.000
C8	C7	C29	120.000	C8	C9	C10	108.000
C8	C26	C25	108.000	C8	C26	C27	120.000
C9	C8	C26	108.000	C9	C10	C11	120.000
C9	C10	C25	108.000	C10	C11	C12	120.000
C10	C11	C22	120.000	C10	C25	C24	120.000
C10	C25	C26	108.000	C11	C10	C25	120.000
C11	C12	C13	108.000	C11	C22	C21	108.000
C11	C22	C23	120.000	C12	C11	C22	108.000
C12	C13	C14	120.000	C12	C13	C21	108.000
C13	C14	C15	120.000	C13	C14	C18	120.000
C13	C21	C20	120.000	C13	C21	C22	108.000
C14	C13	C21	120.000	C14	C15	C16	108.000
C14	C18	C17	108.000	C14	C18	C19	120.000
C15	C14	C18	108.000	C15	C16	C17	108.000
C15	C16	C57	120.000	C16	C17	C18	108.000
C16	C17	C43	120.000	C16	C57	C56	120.000
C16	C57	C58	120.000	C17	C16	C57	120.000
C17	C18	C19	120.000	C17	C43	C42	120.000
C17	C43	C44	120.000	C18	C17	C43	120.000
C18	C19	C20	120.000	C18	C19	C41	120.000
C19	C20	C21	120.000	C19	C20	C39	108.000
C19	C41	C40	108.000	C19	C41	C42	120.000
C20	C19	C41	108.000	C20	C21	C22	120.000
C20	C39	C38	120.000	C20	C39	C40	108.000
C21	C20	C39	120.000	C21	C22	C23	120.000
C22	C23	C24	120.000	C22	C23	C38	120.000
C23	C24	C25	120.000	C23	C24	C36	108.000
C23	C38	C37	108.000	C23	C38	C39	120.000
C24	C23	C38	108.000	C24	C25	C26	120.000
C24	C36	C35	120.000	C24	C36	C37	108.000
C25	C24	C36	120.000	C25	C26	C27	120.000
C26	C27	C28	120.000	C26	C27	C35	120.000
C27	C28	C29	120.000	C27	C28	C33	108.000
C27	C35	C34	108.000	C27	C35	C36	120.000
C28	C27	C35	108.000	C28	C29	C30	120.000
C28	C33	C32	120.000	C28	C33	C34	108.000
C29	C28	C33	120.000	C29	C30	C31	120.000
C29	C30	C60	108.000	C30	C31	C32	120.000
C30	C31	C54	120.000	C30	C60	C59	120.000
C31	C30	C60	120.000	C31	C32	C33	120.000
C31	C32	C52	108.000	C31	C54	C53	108.000
C31	C54	C55	120.000	C32	C31	C54	108.000
C32	C33	C34	120.000	C32	C52	C51	120.000
C32	C52	C53	108.000	C33	C32	C52	120.000
C33	C34	C35	108.000	C33	C34	C50	120.000
C34	C35	C36	120.000	C34	C50	C49	120.000
C34	C50	C51	120.000	C35	C34	C50	120.000
C35	C36	C37	120.000	C36	C37	C38	108.000
C36	C37	C49	120.000	C37	C38	C39	120.000
C37	C49	C48	120.000	C37	C49	C50	120.000
C38	C37	C49	120.000	C38	C39	C40	120.000
C39	C40	C41	108.000	C39	C40	C48	120.000
C40	C41	C42	120.000	C40	C48	C47	120.000
C40	C48	C49	120.000	C41	C40	C48	120.000
C41	C42	C43	120.000	C41	C42	C46	120.000
C42	C43	C44	108.000	C42	C46	C45	108.000
C42	C46	C47	120.000	C43	C42	C46	108.000
C43	C44	C45	108.000	C43	C44	C56	120.000
C44	C45	C46	108.000	C44	C45	C53	120.000
C44	C56	C55	120.000	C44	C56	C57	120.000
C45	C44	C56	120.000	C45	C46	C47	120.000
C45	C53	C52	120.000	C45	C53	C54	120.000
C46	C45	C53	120.000	C46	C47	C48	120.000
C46	C47	C51	120.000	C47	C48	C49	108.000
C47	C51	C50	108.000	C47	C51	C52	120.000
C48	C47	C51	108.000	C48	C49	C50	108.000
C49	C50	C51	108.000	C50	C51	C52	120.000
C51	C52	C53	120.000	C52	C53	C54	108.000
C53	C54	C55	120.000	C54	C55	C56	120.000
C54	C55	C59	120.000	C55	C56	C57	108.000
C55	C59	C58	108.000	C55	C59	C60	120.000
C56	C55	C59	108.000	C56	C57	C58	108.000
C57	C58	C59	108.000	C58	C59	C60	120.000

<r²>	4675.159
(<r²>)^1/2	68.375

All results from a given calculation for C₆₀ (Buckminsterfullerene)

using model chemistry: HF/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 C60 (Buckminsterfullerene)

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

States and conformations

All results from a given calculation for C₆₀ (Buckminsterfullerene)