@<TRIPOS>MOLECULE
DB02057
23 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.7952    -2.3721     0.1366	O.2	1	noname	-0.2495
2	C1    -2.5514    -2.4779     0.0719	C.2	1	noname	0.1439
3	O2    -1.9954    -3.5690    -0.4963	O.3	1	noname	-0.2139
4	C2    -1.6999    -1.4215     0.6109	C.3	1	noname	0.0955
5	N1    -0.8474    -1.9720     1.6633	N.3	1	noname	-0.3191
6	C3    -0.8255    -0.8508    -0.5074	C.3	1	noname	0.0036
7	C4     0.0260     0.2056     0.0315	C.2	1	noname	0.0905
8	C5     1.2989     0.0459     0.5690	C.2	1	noname	0.1235
9	C6    -0.2846     1.5604     0.1035	C.2	1	noname	0.1035
10	O3     1.9809    -1.1127     0.6914	O.3	1	noname	-0.2385
11	N2     1.7214     1.2713     0.9446	N.2	1	noname	-0.1510
12	O4     0.7975     2.1500     0.6722	O.3	1	noname	-0.3455
13	C7    -1.5147     2.2103    -0.3394	C.3	1	noname	0.0616
14	H1    -1.6907    -4.1671     0.1901	H	1	noname	0.2213
15	H2    -2.3423    -0.6610     1.0548	H	1	noname	0.0575
16	H3     0.1268    -2.1622     1.4762	H	1	noname	0.1191
17	H4    -1.2325    -2.1622     2.5774	H	1	noname	0.1191
18	H5    -0.1509    -1.6422    -0.8341	H	1	noname	0.0340
19	H6    -1.4857    -0.3661    -1.2266	H	1	noname	0.0340
20	H7     2.1010    -1.3166     1.6217	H	1	noname	0.2199
21	H8    -2.0964     2.5176     0.5296	H	1	noname	0.0301
22	H9    -1.2673     3.0861    -0.9393	H	1	noname	0.0301
23	H10    -2.0987     1.5122    -0.9393	H	1	noname	0.0301
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	7	8	1
8	7	9	2
9	8	10	1
10	8	11	2
11	9	12	1
12	9	13	1
13	11	12	1
14	3	14	1
15	4	15	1
16	5	16	1
17	5	17	1
18	6	18	1
19	6	19	1
20	10	20	1
21	13	21	1
22	13	22	1
23	13	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1