@<TRIPOS>MOLECULE
DB03217
27 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     3.3561    -0.2060     0.1959	P	1	noname	0.0301
2	O1     3.3366    -0.7680     1.5215	O.2	1	noname	-0.2212
3	O2     4.7435    -0.4268    -0.4349	O.3	1	noname	-0.1873
4	O3     3.0621     1.3037     0.2740	O.3	1	noname	-0.1873
5	C1     2.2069    -0.9429    -0.7309	C.3	1	noname	0.1858
6	O4     2.4780    -2.3349    -0.8029	O.3	1	noname	-0.3741
7	C2     2.2267    -0.3730    -2.0749	C.2	1	noname	-0.0226
8	C3     1.4312     0.7265    -2.3754	C.2	1	noname	-0.0275
9	C4     3.0410    -0.9301    -3.0541	C.2	1	noname	-0.0399
10	C5     1.4501     1.2691    -3.6550	C.2	1	noname	-0.0371
11	C6     0.6170     1.2836    -1.3963	C.2	1	noname	-0.0433
12	C7     3.0598    -0.3876    -4.3337	C.2	1	noname	-0.0521
13	C8     2.2643     0.7120    -4.6342	C.2	1	noname	-0.0463
14	C9     0.6546     2.3686    -3.9555	C.2	1	noname	-0.0470
15	C10    -0.1785     2.3832    -1.6967	C.2	1	noname	-0.0563
16	C11    -0.1596     2.9257    -2.9763	C.2	1	noname	-0.0569
17	H1     5.3979    -0.5309     0.2597	H	1	noname	0.2260
18	H2     3.0097     1.5723     1.1942	H	1	noname	0.2260
19	H3     1.1765    -0.8819    -0.3808	H	1	noname	0.0810
20	H4     2.5479    -2.6937     0.0848	H	1	noname	0.2120
21	H5     3.6647    -1.7924    -2.8185	H	1	noname	0.0626
22	H6     0.6022     0.8582    -0.3928	H	1	noname	0.0629
23	H7     3.6983    -0.8244    -5.1015	H	1	noname	0.0622
24	H8     2.2791     1.1374    -5.6376	H	1	noname	0.0629
25	H9     0.6694     2.7941    -4.9589	H	1	noname	0.0629
26	H10    -0.8170     2.8200    -0.9289	H	1	noname	0.0622
27	H11    -0.7834     3.7880    -3.2119	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	5	6	1
6	5	7	1
7	7	8	1
8	7	9	2
9	8	10	1
10	8	11	2
11	9	12	1
12	10	13	1
13	10	14	2
14	11	15	1
15	12	13	2
16	14	16	1
17	15	16	2
18	3	17	1
19	4	18	1
20	5	19	1
21	6	20	1
22	9	21	1
23	11	22	1
24	12	23	1
25	13	24	1
26	14	25	1
27	15	26	1
28	16	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1