@<TRIPOS>MOLECULE
92283028
39 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.1620    -1.4275    -0.6246	O.3	1	noname	-0.3815
2	C1     0.0289     0.2082     0.6246	C.3	1	noname	-0.0421
3	C2    -0.2656     1.0410    -0.6246	C.3	1	noname	-0.0506
4	C3    -1.7378     1.4574    -0.6246	C.3	1	noname	-0.0528
5	C4    -2.0323     2.2903    -1.8739	C.3	1	noname	-0.0509
6	C5     1.5011    -0.2082     0.6246	C.3	1	noname	-0.0270
7	C6    -3.5045     2.7067    -1.8739	C.3	1	noname	-0.0471
8	C7    -0.2656     1.0410     1.8739	C.3	1	noname	-0.0624
9	C8     1.7956    -1.0410    -0.6246	C.3	1	noname	0.0469
10	C9    -3.7990     3.5395    -3.1231	C.3	1	noname	-0.0628
11	C10    -3.7990     3.5395    -0.6246	C.3	1	noname	-0.0628
12	C11     3.4352    -2.2005    -1.7840	C.3	1	noname	0.0438
13	C12     4.9075    -2.6169    -1.7840	C.3	1	noname	-0.0416
14	H1    -0.6004    -0.6818     0.6246	H	1	noname	0.0300
15	H2    -0.0558     0.4477    -1.5146	H	1	noname	0.0269
16	H3     0.3637     1.9310    -0.6246	H	1	noname	0.0269
17	H4    -2.3671     0.5675    -0.6246	H	1	noname	0.0267
18	H5    -1.9476     2.0508     0.2654	H	1	noname	0.0267
19	H6    -1.8225     1.6970    -2.7638	H	1	noname	0.0269
20	H7    -1.4030     3.1803    -1.8739	H	1	noname	0.0269
21	H8     1.7109    -0.8015     1.5146	H	1	noname	0.0293
22	H9     2.1304     0.6818     0.6246	H	1	noname	0.0293
23	H10    -4.1338     1.8167    -1.8739	H	1	noname	0.0297
24	H11    -0.0558     0.4477     2.7638	H	1	noname	0.0233
25	H12    -1.3144     1.3377     1.8739	H	1	noname	0.0233
26	H13     0.3637     1.9310     1.8739	H	1	noname	0.0233
27	H14     1.1663    -1.9310    -0.6246	H	1	noname	0.0566
28	H15     1.5858    -0.4477    -1.5146	H	1	noname	0.0566
29	H16    -4.8478     3.8362    -3.1231	H	1	noname	0.0233
30	H17    -3.5892     2.9462    -4.0131	H	1	noname	0.0233
31	H18    -3.1696     4.4295    -3.1231	H	1	noname	0.0233
32	H19    -4.8478     3.8362    -0.6246	H	1	noname	0.0233
33	H20    -3.5892     2.9462     0.2654	H	1	noname	0.0233
34	H21    -3.1696     4.4295    -0.6246	H	1	noname	0.0233
35	H22     2.8059    -3.0904    -1.7840	H	1	noname	0.0563
36	H23     3.2255    -1.6071    -2.6740	H	1	noname	0.0563
37	H24     5.1173    -3.2102    -2.6740	H	1	noname	0.0254
38	H25     5.1173    -3.2102    -0.8941	H	1	noname	0.0254
39	H26     5.5368    -1.7269    -1.7840	H	1	noname	0.0254
@<TRIPOS>BOND
1	1	9	1
2	1	12	1
3	2	3	1
4	2	6	1
5	2	8	1
6	2	14	1
7	3	4	1
8	3	15	1
9	3	16	1
10	4	5	1
11	4	17	1
12	4	18	1
13	5	7	1
14	5	19	1
15	5	20	1
16	6	9	1
17	6	21	1
18	6	22	1
19	7	10	1
20	7	11	1
21	7	23	1
22	8	24	1
23	8	25	1
24	8	26	1
25	9	27	1
26	9	28	1
27	10	29	1
28	10	30	1
29	10	31	1
30	11	32	1
31	11	33	1
32	11	34	1
33	12	13	1
34	12	35	1
35	12	36	1
36	13	37	1
37	13	38	1
38	13	39	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1