@<TRIPOS>MOLECULE
DB02609
23 22 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     3.5792     0.0361     0.3962	P	1	noname	0.0149
2	O1     4.4670    -0.6272     1.3158	O.2	1	noname	-0.1967
3	O2     2.1643    -0.5568     0.5307	O.3	1	noname	-0.1526
4	O3     4.0863    -0.1671    -1.0437	O.3	1	noname	-0.1645
5	O4     3.5378     1.5415     0.7181	O.3	1	noname	-0.1645
6	C1     1.2889     0.0973    -0.3761	C.3	1	noname	0.0905
7	C2    -0.1168    -0.4918    -0.2425	C.3	1	noname	0.1031
8	O5    -0.5843    -0.3044     1.0851	O.3	1	noname	-0.3884
9	C3    -1.0601     0.2129    -1.2196	C.3	1	noname	0.1198
10	N1    -2.4033    -0.3499    -1.0919	N.3	1	noname	-0.3172
11	C4    -0.5794     0.0203    -2.5847	C.2	1	noname	0.1450
12	O6    -0.2785     1.0097    -3.2868	O.2	1	noname	-0.2487
13	O7    -0.4598    -1.2264    -3.0886	O.3	1	noname	-0.2133
14	H1     4.1519    -1.1065    -1.2302	H	1	noname	0.2283
15	H2     3.5344     1.6651     1.6701	H	1	noname	0.2283
16	H3     1.2525     1.1358    -0.0473	H	1	noname	0.0605
17	H4     1.6643    -0.1469    -1.3699	H	1	noname	0.0605
18	H5    -0.1132    -1.5702    -0.4006	H	1	noname	0.0647
19	H6    -0.7294    -1.1593     1.4970	H	1	noname	0.2106
20	H7    -1.1192     1.2844    -1.0285	H	1	noname	0.0600
21	H8    -3.2053     0.2624    -1.0478	H	1	noname	0.1192
22	H9    -2.5293    -1.3511    -1.0478	H	1	noname	0.1192
23	H10    -0.3993    -1.8582    -2.3683	H	1	noname	0.2213
@<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	2
12	11	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	10	22	1
22	13	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1