@<TRIPOS>MOLECULE
DB01679
22 21 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     1.6273    -0.1806     0.0295	P	1	noname	0.0662
2	O1     2.4699    -1.2730    -0.3830	O.2	1	noname	-0.1858
3	O2     2.0937     1.1157    -0.6588	O.3	1	noname	-0.0281
4	O3     1.7173    -0.0115     1.5575	O.3	1	noname	-0.1475
5	O4     0.1697    -0.4776    -0.3691	O.3	1	noname	-0.1576
6	P2     2.0037     0.9466    -2.1868	P	1	noname	0.0622
7	C1     0.8864     1.0658     1.9643	C.3	1	noname	0.0622
8	O5     2.4398     2.1588    -2.8304	O.2	1	noname	-0.1871
9	O6     0.5462     0.6496    -2.5854	O.3	1	noname	-0.1585
10	O7     2.9048    -0.2217    -2.6280	O.3	1	noname	-0.1585
11	C2     0.9758     1.2338     3.4824	C.3	1	noname	-0.0314
12	C3     0.0805     2.3945     3.9207	C.3	1	noname	-0.0632
13	H1    -0.3627    -0.5861     0.4223	H	1	noname	0.2283
14	H2     1.3145     1.9544     1.5005	H	1	noname	0.0576
15	H3    -0.1299     0.7583     1.7179	H	1	noname	0.0576
16	H4     0.0137     0.5411    -1.7940	H	1	noname	0.2283
17	H5     3.2504    -0.6697    -1.8525	H	1	noname	0.2283
18	H6     0.5574     0.3294     3.9243	H	1	noname	0.0287
19	H7     2.0018     1.5256     3.7068	H	1	noname	0.0287
20	H8     0.0477     2.4370     5.0094	H	1	noname	0.0231
21	H9     0.4827     3.3302     3.5325	H	1	noname	0.0231
22	H10    -0.9267     2.2431     3.5325	H	1	noname	0.0231
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	4	7	1
7	6	8	2
8	6	9	1
9	6	10	1
10	7	11	1
11	11	12	1
12	5	13	1
13	7	14	1
14	7	15	1
15	9	16	1
16	10	17	1
17	11	18	1
18	11	19	1
19	12	20	1
20	12	21	1
21	12	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1