@<TRIPOS>MOLECULE
DB03815
25 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -2.2119     0.6392    -0.3913	O.3	1	noname	-0.3874
2	C1    -0.8375     0.3658    -0.1617	C.3	1	noname	0.1106
3	C2    -0.0609     1.6821    -0.0891	C.3	1	noname	0.1081
4	C3    -0.2889    -0.4874    -1.3071	C.3	1	noname	0.1056
5	O2    -0.5700     2.4740     0.9740	O.3	1	noname	-0.3875
6	C4    -0.2167     2.4396    -1.4092	C.3	1	noname	0.0798
7	O3    -1.0097    -1.7090    -1.3745	O.3	1	noname	-0.3878
8	C5     1.1919    -0.7819    -1.0598	C.3	1	noname	0.0718
9	O4     0.5041     3.6613    -1.3418	O.3	1	noname	-0.3905
10	C6     0.3319     1.5864    -2.5546	C.3	1	noname	-0.0363
11	O5     1.7010    -1.5738    -2.1228	O.3	1	noname	-0.3934
12	H1    -2.6651     0.7293     0.4502	H	1	noname	0.2106
13	H2    -0.8016    -0.1703     0.7866	H	1	noname	0.0657
14	H3     0.9887     1.5123     0.1510	H	1	noname	0.0655
15	H4    -0.4430    -0.0047    -2.2722	H	1	noname	0.0652
16	H5    -0.9028     1.9012     1.6688	H	1	noname	0.2106
17	H6    -1.2543     2.7230    -1.5855	H	1	noname	0.0625
18	H7    -1.1939    -2.0213    -0.4856	H	1	noname	0.2106
19	H8     1.7370     0.1605    -1.1124	H	1	noname	0.0591
20	H9     1.2679    -1.4065    -0.1697	H	1	noname	0.0591
21	H10     0.6447     3.8996    -0.4226	H	1	noname	0.2105
22	H11     0.2146     0.5308    -2.3098	H	1	noname	0.0257
23	H12    -0.2168     1.8103    -3.4695	H	1	noname	0.0257
24	H13     1.3886     1.8103    -2.7007	H	1	noname	0.0257
25	H14     1.5978    -2.5036    -1.9072	H	1	noname	0.2101
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	1
7	4	8	1
8	6	9	1
9	6	10	1
10	8	11	1
11	1	12	1
12	2	13	1
13	3	14	1
14	4	15	1
15	5	16	1
16	6	17	1
17	7	18	1
18	8	19	1
19	8	20	1
20	9	21	1
21	10	22	1
22	10	23	1
23	10	24	1
24	11	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1