@<TRIPOS>MOLECULE
DB03828
25 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -1.9904    -0.7033    -0.3636	P	1	noname	0.0304
2	O1    -2.8996    -1.7876    -0.6303	O.2	1	noname	-0.1933
3	O2    -0.7039    -1.2576     0.2761	O.3	1	noname	-0.1038
4	O3    -1.6414     0.0102    -1.6830	O.3	1	noname	-0.1624
5	O4    -2.6536     0.2972     0.6012	O.3	1	noname	-0.1624
6	C1     0.1485    -0.2410     0.5261	C.2	1	noname	0.0672
7	C2     1.0718     0.1450    -0.4386	C.2	1	noname	0.0332
8	C3     0.1028     0.4197     1.7482	C.2	1	noname	0.0332
9	C4     1.9494     1.1917    -0.1812	C.2	1	noname	-0.0004
10	C5     1.1165    -0.5015    -1.6343	C.2	1	noname	0.1039
11	C6     0.9804     1.4664     2.0056	C.2	1	noname	-0.0004
12	C7    -0.8006     0.0420     2.6920	C.2	1	noname	0.1039
13	C8     1.9037     1.8524     1.0409	C.2	1	noname	-0.0349
14	O5     1.9269    -0.1627    -2.4810	O.2	1	noname	-0.3001
15	O6    -0.8407     0.6219     3.7646	O.2	1	noname	-0.3001
16	C9     2.8256     2.9518     1.3113	C.3	1	noname	-0.0009
17	H1    -1.4616    -0.6436    -2.3625	H	1	noname	0.2283
18	H2    -2.4781     0.0324     1.5071	H	1	noname	0.2283
19	H3     2.6735     1.4944    -0.9376	H	1	noname	0.0633
20	H4     0.4723    -1.3303    -1.9279	H	1	noname	0.1099
21	H5     0.9446     1.9845     2.9639	H	1	noname	0.0633
22	H6    -1.5269    -0.7635     2.5837	H	1	noname	0.1099
23	H7     2.9327     3.0796     2.3884	H	1	noname	0.0279
24	H8     3.7981     2.7265     0.8736	H	1	noname	0.0279
25	H9     2.4341     3.8702     0.8736	H	1	noname	0.0279
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	6	7	2
7	6	8	1
8	7	9	1
9	7	10	1
10	8	11	2
11	8	12	1
12	9	13	2
13	10	14	2
14	11	13	1
15	12	15	2
16	13	16	1
17	4	17	1
18	5	18	1
19	9	19	1
20	10	20	1
21	11	21	1
22	12	22	1
23	16	23	1
24	16	24	1
25	16	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1