@<TRIPOS>MOLECULE
DB02630
27 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -1.0406    -2.5882    -2.5401	P	1	noname	0.0149
2	O1    -2.3406    -3.1967    -2.6553	O.2	1	noname	-0.1967
3	O2    -1.0170    -1.6559    -1.3145	O.3	1	noname	-0.1525
4	O3     0.0267    -3.6855    -2.3709	O.3	1	noname	-0.1645
5	O4    -0.7411    -1.7724    -3.8114	O.3	1	noname	-0.1645
6	C1     0.2649    -1.0559    -1.2008	C.3	1	noname	0.0911
7	C2     0.2883    -0.1297     0.0168	C.3	1	noname	0.1069
8	O5    -0.6958     0.8821    -0.1392	O.3	1	noname	-0.3878
9	C3     1.6696     0.5169     0.1393	C.3	1	noname	0.1103
10	O6     1.6913     1.3765     1.2693	O.3	1	noname	-0.3874
11	C4     2.7299    -0.5732     0.3073	C.3	1	noname	0.1056
12	O7     4.0118     0.0268     0.4210	O.3	1	noname	-0.3878
13	C5     2.7065    -1.4994    -0.9103	C.3	1	noname	0.0718
14	O8     3.6906    -2.5112    -0.7544	O.3	1	noname	-0.3934
15	H1     0.1791    -3.8422    -1.4362	H	1	noname	0.2283
16	H2    -0.5689    -2.3705    -4.5423	H	1	noname	0.2283
17	H3     0.9553    -1.8782    -1.0129	H	1	noname	0.0605
18	H4     0.3789    -0.4420    -2.0943	H	1	noname	0.0605
19	H5     0.0161    -0.6628     0.9277	H	1	noname	0.0653
20	H6    -0.9868     1.1813     0.7253	H	1	noname	0.2106
21	H7     1.8874     1.1556    -0.7167	H	1	noname	0.0656
22	H8     1.7067     0.8498     2.0718	H	1	noname	0.2106
23	H9     2.5855    -1.1296     1.2334	H	1	noname	0.0652
24	H10     4.2351     0.1313     1.3488	H	1	noname	0.2106
25	H11     1.7503    -2.0226    -0.9183	H	1	noname	0.0591
26	H12     3.0188    -0.9216    -1.7802	H	1	noname	0.0591
27	H13     3.8430    -2.6679     0.1804	H	1	noname	0.2101
@<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	11	13	1
13	13	14	1
14	4	15	1
15	5	16	1
16	6	17	1
17	6	18	1
18	7	19	1
19	8	20	1
20	9	21	1
21	10	22	1
22	11	23	1
23	12	24	1
24	13	25	1
25	13	26	1
26	14	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1