@<TRIPOS>MOLECULE
DB03298
18 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -1.9904    -0.7033    -0.3636	P	1	noname	0.0288
2	O1    -2.8996    -1.7876    -0.6303	O.2	1	noname	-0.1935
3	O2    -0.7039    -1.2576     0.2761	O.3	1	noname	-0.1180
4	O3    -1.6414     0.0102    -1.6830	O.3	1	noname	-0.1625
5	O4    -2.6536     0.2972     0.6012	O.3	1	noname	-0.1625
6	C1     0.1485    -0.2410     0.5261	C.2	1	noname	0.0099
7	C2     1.0718     0.1450    -0.4386	C.2	1	noname	-0.0115
8	C3     0.1028     0.4197     1.7482	C.2	1	noname	-0.0115
9	C4     1.9494     1.1917    -0.1812	C.2	1	noname	-0.0473
10	C5     0.9804     1.4664     2.0056	C.2	1	noname	-0.0473
11	C6     1.9037     1.8524     1.0409	C.2	1	noname	-0.0580
12	H1    -1.4616    -0.6436    -2.3625	H	1	noname	0.2283
13	H2    -2.4781     0.0324     1.5071	H	1	noname	0.2283
14	H3     1.1076    -0.3731    -1.3969	H	1	noname	0.0650
15	H4    -0.6213     0.1170     2.5046	H	1	noname	0.0650
16	H5     2.6735     1.4944    -0.9376	H	1	noname	0.0623
17	H6     0.9446     1.9845     2.9639	H	1	noname	0.0623
18	H7     2.5920     2.6732     1.2428	H	1	noname	0.0622
@<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	8	10	2
10	9	11	2
11	10	11	1
12	4	12	1
13	5	13	1
14	7	14	1
15	8	15	1
16	9	16	1
17	10	17	1
18	11	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
