@<TRIPOS>MOLECULE
DB02018
25 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.0987    -3.1088    -0.7255	O.2	1	noname	-0.2341
2	C1    -2.0232    -2.7091    -0.2295	C.2	1	noname	0.1665
3	O2    -1.3669    -3.4764     0.6667	O.3	1	noname	-0.2012
4	C2    -1.5029    -1.4748    -0.6008	C.2	1	noname	0.2133
5	O3    -1.7242    -1.0217    -1.7445	O.2	1	noname	-0.2569
6	C3    -0.6979    -0.7075     0.3452	C.3	1	noname	0.0417
7	C4    -0.2728     0.5420    -0.2789	C.2	1	noname	-0.0472
8	C5     0.9244     0.5951    -0.9831	C.2	1	noname	-0.0458
9	C6    -1.0653     1.6786    -0.1688	C.2	1	noname	-0.0458
10	C7     1.3291     1.7847    -1.5773	C.2	1	noname	-0.0349
11	C8    -0.6606     2.8683    -0.7630	C.2	1	noname	-0.0349
12	C9     0.5366     2.9213    -1.4672	C.2	1	noname	-0.0253
13	C10     0.9326     4.0853    -2.0486	C.2	1	noname	-0.0768
14	N1     0.2056     5.1279    -1.9476	N.2	1	noname	-0.2746
15	N2     2.0609     4.1353    -2.7123	N.3	1	noname	-0.1374
16	H1    -1.6019    -3.2016     1.5560	H	1	noname	0.2217
17	H2    -1.3552    -0.4386     1.1721	H	1	noname	0.0402
18	H3     0.2051    -1.2883     0.5335	H	1	noname	0.0402
19	H4     1.5459    -0.2962    -1.0694	H	1	noname	0.0625
20	H5    -2.0042     1.6371     0.3834	H	1	noname	0.0625
21	H6     2.2679     1.8263    -2.1295	H	1	noname	0.0630
22	H7    -1.2821     3.7596    -0.6767	H	1	noname	0.0630
23	H8     0.0568     5.3413    -0.9717	H	1	noname	0.1888
24	H9     2.5345     3.2807    -2.9681	H	1	noname	0.1257
25	H10     2.4571     5.0284    -2.9681	H	1	noname	0.1257
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	6	7	1
7	7	8	2
8	7	9	1
9	8	10	1
10	9	11	2
11	10	12	2
12	11	12	1
13	12	13	1
14	13	14	2
15	13	15	1
16	3	16	1
17	6	17	1
18	6	18	1
19	8	19	1
20	9	20	1
21	10	21	1
22	11	22	1
23	14	23	1
24	15	24	1
25	15	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1