@<TRIPOS>MOLECULE
DB03459
26 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     1.8734    -2.2537    -0.5118	P	1	noname	0.0179
2	O1     2.2789    -3.5333     0.0095	O.2	1	noname	-0.2286
3	O2     0.5592    -2.4130    -1.2986	O.3	1	noname	-0.1930
4	O3     2.9692    -1.7100    -1.4474	O.3	1	noname	-0.1930
5	C1     1.6429    -1.1993     0.7363	C.3	1	noname	0.1188
6	C2     1.2403     0.0714     0.2186	C.2	1	noname	0.0286
7	O4     2.1499     0.9775    -0.0879	O.3	1	noname	-0.2614
8	N1     0.0026     0.3292     0.0531	N.2	1	noname	-0.2167
9	C3    -0.3846     1.5511    -0.4447	C.3	1	noname	0.1471
10	C4    -1.8407     1.5988    -0.5394	C.2	1	noname	0.1480
11	C5     0.2238     1.7517    -1.8341	C.3	1	noname	0.0656
12	O5    -2.4804     2.4639     0.0967	O.2	1	noname	-0.2466
13	O6    -2.4962     0.7084    -1.3141	O.3	1	noname	-0.2116
14	C6    -0.1873     3.0491    -2.3627	C.2	1	noname	0.1361
15	O7    -0.8364     3.1123    -3.4290	O.2	1	noname	-0.2551
16	O8     0.1336     4.1805    -1.6997	O.3	1	noname	-0.2182
17	H1    -0.1729    -2.5017    -0.6841	H	1	noname	0.2259
18	H2     3.6894    -1.3526    -0.9228	H	1	noname	0.2259
19	H3     0.7908    -1.5292     1.3306	H	1	noname	0.0506
20	H4     2.6000    -1.0014     1.2189	H	1	noname	0.0506
21	H5     2.5194     1.3455     0.7181	H	1	noname	0.2195
22	H6    -0.0408     2.2777     0.2915	H	1	noname	0.0667
23	H7     1.3059     1.8058    -1.7150	H	1	noname	0.0400
24	H8    -0.2150     1.0055    -2.4965	H	1	noname	0.0400
25	H9    -2.9595     0.0792    -0.7565	H	1	noname	0.2213
26	H10     0.0884     4.0210    -0.7541	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	5	6	1
6	6	7	1
7	6	8	2
8	9	8	1
9	9	10	1
10	9	11	1
11	10	12	2
12	10	13	1
13	11	14	1
14	14	15	2
15	14	16	1
16	3	17	1
17	4	18	1
18	5	19	1
19	5	20	1
20	7	21	1
21	9	22	1
22	11	23	1
23	11	24	1
24	13	25	1
25	16	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1