@<TRIPOS>MOLECULE
DB03717
35 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     5.3218    -0.7471    -1.4532	O.3	1	noname	-0.3470
2	C1     3.8699    -0.6939    -1.7016	C.3	1	noname	0.1864
3	C2     6.3277    -0.4205    -2.4721	C.3	1	noname	0.0786
4	O2     3.2042    -0.0505    -0.5578	O.3	1	noname	-0.3432
5	C3     3.5212    -0.0317    -3.0737	C.3	1	noname	0.1333
6	C4     5.9272     0.7634    -3.4154	C.3	1	noname	0.1061
7	C5     1.7398    -0.0869    -0.4448	C.3	1	noname	0.0963
8	O3     3.7216    -0.9728    -4.1180	O.3	1	noname	-0.3849
9	C6     4.4367     1.1896    -3.2994	C.3	1	noname	0.1130
10	O4     6.2165     0.4151    -4.7612	O.3	1	noname	-0.3878
11	C7     1.1838     0.3884     0.9507	C.3	1	noname	0.1438
12	C8     0.9756     0.7447    -1.5300	C.3	1	noname	-0.0038
13	O5     4.2871     2.0992    -2.2192	O.3	1	noname	-0.3873
14	O6     1.5818    -0.4842     1.9908	O.3	1	noname	-0.3818
15	C9    -0.2894     0.4759     0.9530	C.2	1	noname	0.0335
16	C10    -0.5450     0.4374    -1.4632	C.3	1	noname	0.0442
17	O7    -0.9103     0.5486     2.1156	O.3	1	noname	-0.2570
18	N1    -1.0103     0.4852    -0.1359	N.2	1	noname	-0.2201
19	H1     3.5104    -1.7228    -1.7180	H	1	noname	0.0951
20	H2     7.1971    -0.0928    -1.9020	H	1	noname	0.0595
21	H3     6.3881    -1.3148    -3.0923	H	1	noname	0.0595
22	H4     2.4689     0.2428    -3.1472	H	1	noname	0.0682
23	H5     6.5527     1.6276    -3.1914	H	1	noname	0.0653
24	H6     1.6246    -1.1593    -0.6023	H	1	noname	0.0637
25	H7     3.6537    -1.8627    -3.7643	H	1	noname	0.2108
26	H8     4.1197     1.7393    -4.1856	H	1	noname	0.0658
27	H9     6.2350    -0.5408    -4.8474	H	1	noname	0.2106
28	H10     1.5858     1.3640     1.2239	H	1	noname	0.0718
29	H11     1.0913     1.7948    -1.2616	H	1	noname	0.0313
30	H12     1.3211     0.3891    -2.5007	H	1	noname	0.0313
31	H13     4.1739     1.6092    -1.4015	H	1	noname	0.2106
32	H14     1.4723    -1.3941     1.7046	H	1	noname	0.2112
33	H15    -1.0772     1.2414    -1.9715	H	1	noname	0.0516
34	H16    -0.6968    -0.5970    -1.7718	H	1	noname	0.0516
35	H17    -1.0843    -0.3376     2.4414	H	1	noname	0.2196
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	1
6	7	4	1
7	5	8	1
8	5	9	1
9	6	10	1
10	6	9	1
11	7	11	1
12	7	12	1
13	9	13	1
14	11	14	1
15	11	15	1
16	12	16	1
17	15	17	1
18	15	18	2
19	16	18	1
20	2	19	1
21	3	20	1
22	3	21	1
23	5	22	1
24	6	23	1
25	7	24	1
26	8	25	1
27	9	26	1
28	10	27	1
29	11	28	1
30	12	29	1
31	12	30	1
32	13	31	1
33	14	32	1
34	16	33	1
35	16	34	1
36	17	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1