@<TRIPOS>MOLECULE
71587815
35 34 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.3922    -0.3221    -0.3579	O.3	1	noname	-0.2071
2	O2     3.4388    -1.2480    -0.1955	O.2	1	noname	-0.2541
3	C1    -2.9050     1.9701    -0.9615	C.3	1	noname	-0.0470
4	C2    -2.1806     0.8097    -0.2762	C.3	1	noname	-0.0487
5	C3    -0.7033     0.8245    -0.6740	C.3	1	noname	-0.0287
6	C4     0.0211    -0.3359     0.0113	C.3	1	noname	0.0564
7	C5     1.9607    -3.6694     0.4185	C.3	1	noname	-0.0378
8	C6    -4.3823     1.9553    -0.5637	C.3	1	noname	-0.0628
9	C7    -2.2730     3.2939    -0.5266	C.3	1	noname	-0.0628
10	C8     1.7303    -2.2887     1.0362	C.3	1	noname	0.0360
11	C9     2.2319    -1.2601     0.1295	C.2	1	noname	0.1400
12	C10     1.4351    -4.7473     1.3686	C.3	1	noname	-0.0623
13	C11     1.2193    -3.7609    -0.9167	C.3	1	noname	-0.0623
14	H1    -2.8188     1.8644    -2.0429	H	1	noname	0.0297
15	H2    -2.6309    -0.1334    -0.5861	H	1	noname	0.0270
16	H3    -2.2668     0.9155     0.8052	H	1	noname	0.0270
17	H4    -0.6171     0.7188    -1.7554	H	1	noname	0.0290
18	H5    -0.2530     1.7676    -0.3642	H	1	noname	0.0290
19	H6     3.0274    -3.8199     0.2528	H	1	noname	0.0302
20	H7    -0.4292    -1.2790    -0.2986	H	1	noname	0.0573
21	H8    -0.0651    -0.2301     1.0927	H	1	noname	0.0573
22	H9    -2.7890     4.1206    -1.0148	H	1	noname	0.0233
23	H10    -2.3591     3.3997     0.5548	H	1	noname	0.0233
24	H11    -1.2205     3.3045    -0.8100	H	1	noname	0.0233
25	H12    -4.8983     2.7820    -1.0519	H	1	noname	0.0233
26	H13    -4.8325     1.0122    -0.8736	H	1	noname	0.0233
27	H14    -4.4685     2.0611     0.5177	H	1	noname	0.0233
28	H15     0.6635    -2.1382     1.2018	H	1	noname	0.0375
29	H16     2.2585    -2.2235     1.9874	H	1	noname	0.0375
30	H17     1.3834    -4.7446    -1.3568	H	1	noname	0.0233
31	H18     0.1525    -3.6104    -0.7510	H	1	noname	0.0233
32	H19     1.5937    -2.9930    -1.5936	H	1	noname	0.0233
33	H20     1.5992    -5.7309     0.9286	H	1	noname	0.0233
34	H21     0.3683    -4.5968     1.5343	H	1	noname	0.0233
35	H22     1.9632    -4.6821     2.3199	H	1	noname	0.0233
@<TRIPOS>BOND
1	1	6	1
2	1	11	1
3	2	11	2
4	3	4	1
5	3	8	1
6	3	9	1
7	3	14	1
8	4	5	1
9	4	15	1
10	4	16	1
11	5	6	1
12	5	17	1
13	5	18	1
14	6	20	1
15	6	21	1
16	7	10	1
17	7	12	1
18	7	13	1
19	7	19	1
20	8	25	1
21	8	26	1
22	8	27	1
23	9	22	1
24	9	23	1
25	9	24	1
26	10	11	1
27	10	28	1
28	10	29	1
29	12	33	1
30	12	34	1
31	12	35	1
32	13	30	1
33	13	31	1
34	13	32	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1