@<TRIPOS>MOLECULE
DB04087
26 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     3.6409    -0.9331     0.3267	P	1	noname	0.0149
2	O1     4.4552    -0.7941     1.5062	O.2	1	noname	-0.1967
3	O2     2.1929    -0.5211     0.6512	O.3	1	noname	-0.1525
4	O3     4.1946    -0.0274    -0.7890	O.3	1	noname	-0.1645
5	O4     3.6643    -2.3994    -0.1434	O.3	1	noname	-0.1645
6	C1     1.3899    -0.6581    -0.5119	C.3	1	noname	0.0910
7	C2    -0.0487    -0.2488    -0.1896	C.3	1	noname	0.1044
8	O5    -0.0703     1.1032     0.2439	O.3	1	noname	-0.3879
9	C3    -0.9139    -0.3965    -1.4428	C.3	1	noname	0.0845
10	O6    -2.2490    -0.0166    -1.1436	O.3	1	noname	-0.3901
11	C4    -0.3638     0.5033    -2.5512	C.3	1	noname	-0.0010
12	C5    -1.2290     0.3556    -3.8044	C.3	1	noname	0.0457
13	O7    -0.7185     1.1907    -4.8332	O.3	1	noname	-0.3961
14	H1     4.5462    -0.5712    -1.4976	H	1	noname	0.2283
15	H2     3.6736    -2.9803     0.6209	H	1	noname	0.2283
16	H3     1.7920     0.0576    -1.2289	H	1	noname	0.0605
17	H4     1.3940    -1.7231    -0.7442	H	1	noname	0.0605
18	H5    -0.4504    -0.8277     0.6420	H	1	noname	0.0652
19	H6    -0.0707     1.1317     1.2035	H	1	noname	0.2106
20	H7    -0.9723    -1.4358    -1.7660	H	1	noname	0.0629
21	H8    -2.3665     0.0168    -0.1914	H	1	noname	0.2105
22	H9    -0.4795     1.5315    -2.2084	H	1	noname	0.0317
23	H10     0.6251     0.1214    -2.8048	H	1	noname	0.0317
24	H11    -1.1164    -0.6635    -4.1744	H	1	noname	0.0564
25	H12    -2.2210     0.7466    -3.5779	H	1	noname	0.0564
26	H13    -0.3669     0.6469    -5.5418	H	1	noname	0.2100
@<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	1
7	7	8	1
8	7	9	1
9	9	10	1
10	9	11	1
11	11	12	1
12	12	13	1
13	4	14	1
14	5	15	1
15	6	16	1
16	6	17	1
17	7	18	1
18	8	19	1
19	9	20	1
20	10	21	1
21	11	22	1
22	11	23	1
23	12	24	1
24	12	25	1
25	13	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1