@<TRIPOS>MOLECULE
DB03156
23 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.7032    -1.0641    -1.2109	O.2	1	noname	-0.2442
2	C1    -0.7479    -0.2586    -1.1792	C.2	1	noname	0.1515
3	O2    -0.3510     0.3627    -2.3101	O.3	1	noname	-0.2098
4	C2    -0.0252     0.0245     0.1473	C.3	1	noname	0.1743
5	O3     1.3804    -0.3511    -0.0182	O.3	1	noname	-0.3334
6	C3    -0.3152     1.4997     0.5507	C.3	1	noname	0.1186
7	C4     2.3763     0.3179     0.8064	C.3	1	noname	0.1843
8	O4    -0.6903     1.5512     1.9193	O.3	1	noname	-0.3869
9	C5     0.9062     2.4313     0.3128	C.3	1	noname	0.1139
10	O5     3.6750    -0.0990     0.4118	O.3	1	noname	-0.3656
11	C6     2.2941     1.8695     0.7614	C.3	1	noname	0.1332
12	O6     0.9638     2.7954    -1.0585	O.3	1	noname	-0.3873
13	O7     2.6294     2.3984     2.0359	O.3	1	noname	-0.3849
14	H1    -0.1190    -0.2935    -2.9712	H	1	noname	0.2214
15	H2    -0.3275    -0.6040     0.9850	H	1	noname	0.0743
16	H3    -1.1777     1.8733    -0.0012	H	1	noname	0.0662
17	H4     2.2000    -0.0540     1.8158	H	1	noname	0.0949
18	H5    -0.7835     0.6583     2.2594	H	1	noname	0.2107
19	H6     0.7239     3.3502     0.8700	H	1	noname	0.0658
20	H7     4.2072    -0.2699     1.1923	H	1	noname	0.2134
21	H8     3.0590     2.2328     0.0750	H	1	noname	0.0682
22	H9     0.9865     2.0027    -1.5994	H	1	noname	0.2106
23	H10     2.7907     1.6777     2.6491	H	1	noname	0.2108
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	4	2	1
4	4	5	1
5	4	6	1
6	5	7	1
7	6	8	1
8	6	9	1
9	7	10	1
10	7	11	1
11	9	12	1
12	9	11	1
13	11	13	1
14	3	14	1
15	4	15	1
16	6	16	1
17	7	17	1
18	8	18	1
19	9	19	1
20	10	20	1
21	11	21	1
22	12	22	1
23	13	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1