@<TRIPOS>MOLECULE
71587365
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.1236     2.0934    -1.3364	O.3	1	noname	-0.2672
2	O2     0.4597     2.7323    -3.4174	O.3	1	noname	-0.2762
3	O3    -0.8626    -0.6244     4.2928	O.3	1	noname	-0.2211
4	O4    -2.3011    -1.6265     2.8789	O.2	1	noname	-0.2623
5	C1    -0.9637     0.5047    -0.2443	C.2	1	noname	-0.0476
6	C2     0.8385     1.6800    -1.3245	C.2	1	noname	0.0264
7	C3     0.3594     0.9303    -0.2566	C.2	1	noname	-0.0109
8	C4    -0.0056     2.0041    -2.3802	C.2	1	noname	0.0247
9	C5    -1.8078     0.8288    -1.3001	C.2	1	noname	-0.0517
10	C6    -1.3288     1.5785    -2.3680	C.2	1	noname	-0.0209
11	C7    -1.4325    -0.2288     0.8006	C.2	1	noname	-0.0109
12	C8    -0.9170    -0.0611     2.0151	C.2	1	noname	0.0584
13	C9     2.2178     3.3643    -0.7099	C.3	1	noname	0.0424
14	C10    -1.3858    -0.7946     3.0600	C.2	1	noname	0.0912
15	H1     0.9788     0.6925     0.5182	H	1	noname	0.0657
16	H2    -2.7788     0.5165    -1.2911	H	1	noname	0.0629
17	H3    -1.9482     1.8163    -3.1427	H	1	noname	0.0651
18	H4    -2.1574    -0.8877     0.6571	H	1	noname	0.0631
19	H5    -0.1921     0.5977     2.1585	H	1	noname	0.0686
20	H6     3.2554     3.6980    -0.7195	H	1	noname	0.0535
21	H7     1.6003     4.0821    -1.2498	H	1	noname	0.0535
22	H8     1.8701     3.2882     0.3203	H	1	noname	0.0535
23	H9    -0.2594     2.8695    -4.0689	H	1	noname	0.2183
24	H10    -1.4185    -0.7737     5.0859	H	1	noname	0.2216
@<TRIPOS>BOND
1	1	6	1
2	1	13	1
3	2	8	1
4	2	23	1
5	3	14	1
6	3	24	1
7	4	14	2
8	5	7	2
9	5	9	1
10	5	11	1
11	6	7	1
12	6	8	2
13	7	15	1
14	8	10	1
15	9	10	2
16	9	16	1
17	10	17	1
18	11	12	2
19	11	18	1
20	12	14	1
21	12	19	1
22	13	20	1
23	13	21	1
24	13	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
