@<TRIPOS>MOLECULE
DB04491
25 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -0.3616    -0.0428    -0.0046	P	1	noname	0.0186
2	O1     1.0667    -0.0892     0.1724	O.2	1	noname	-0.2324
3	O2    -0.9934     1.0521    -0.8842	O.3	1	noname	-0.1840
4	O3    -1.2573    -1.0881     0.6857	O.3	1	noname	-0.1840
5	C1    -1.2942     2.1865    -0.0848	C.3	1	noname	0.0653
6	C2    -1.4260    -2.2073    -0.1718	C.3	1	noname	0.0653
7	C3    -1.9219     3.2742    -0.9587	C.3	1	noname	-0.0380
8	C4    -2.2774     1.7873     1.0175	C.3	1	noname	-0.0380
9	C5    -2.3159    -3.2458     0.5140	C.3	1	noname	-0.0380
10	C6    -2.0832    -1.7550    -1.4774	C.3	1	noname	-0.0380
11	H1     0.9874    -0.0866     0.1625	H	1	noname	0.1739
12	H2    -0.3403     2.5110     0.3310	H	1	noname	0.0606
13	H3    -0.4223    -2.5954    -0.3451	H	1	noname	0.0606
14	H4    -2.3643     4.0409    -0.3226	H	1	noname	0.0257
15	H5    -1.1534     3.7232    -1.5879	H	1	noname	0.0257
16	H6    -2.6951     2.8335    -1.5879	H	1	noname	0.0257
17	H7    -2.3324     0.7005     1.0792	H	1	noname	0.0257
18	H8    -1.9359     2.1886     1.9717	H	1	noname	0.0257
19	H9    -3.2642     2.1886     0.7869	H	1	noname	0.0257
20	H10    -2.2275    -3.1426     1.5955	H	1	noname	0.0257
21	H11    -3.3529    -3.0882     0.2176	H	1	noname	0.0257
22	H12    -2.0013    -4.2464     0.2176	H	1	noname	0.0257
23	H13    -2.3759    -2.6293    -2.0587	H	1	noname	0.0257
24	H14    -2.9659    -1.1567    -1.2515	H	1	noname	0.0257
25	H15    -1.3760    -1.1567    -2.0519	H	1	noname	0.0257
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	3	5	1
5	4	6	1
6	5	7	1
7	5	8	1
8	6	9	1
9	6	10	1
10	1	11	1
11	5	12	1
12	6	13	1
13	7	14	1
14	7	15	1
15	7	16	1
16	8	17	1
17	8	18	1
18	8	19	1
19	9	20	1
20	9	21	1
21	9	22	1
22	10	23	1
23	10	24	1
24	10	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1