@<TRIPOS>MOLECULE
76956000
25 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -2.8020     4.7191    -1.0657	P	1	noname	0.0155
2	O1    -1.8773     3.4877    -1.0645	O.3	1	noname	-0.1510
3	O2     1.7480     3.6522     0.0414	O.2	1	noname	-0.2820
4	O3     3.4809     1.5401     0.0415	O.3	1	noname	-0.2678
5	O4    -3.7087     4.6789    -2.3099	O.3	1	noname	-0.1644
6	O5    -1.9495     6.0013    -1.0931	O.3	1	noname	-0.1644
7	O6    -3.6162     4.7092     0.1220	O.2	1	noname	-0.1965
8	N1     0.1744    -0.0463     0.1075	N.3	1	noname	-0.0422
9	C1    -0.1646     2.3573     0.0840	C.2	1	noname	0.0549
10	C2     1.5551     0.0656     0.0864	C.2	1	noname	-0.0403
11	C3     1.2586     2.5021     0.0619	C.2	1	noname	0.1073
12	C4    -0.7023     1.0264     0.1074	C.2	1	noname	-0.0661
13	C5    -1.0413     3.5247     0.0828	C.3	1	noname	0.0924
14	C6     2.1411     1.3759     0.0626	C.2	1	noname	0.0340
15	C7     2.3981    -1.1264     0.0884	C.3	1	noname	-0.0266
16	H1    -1.7106     0.8735     0.1236	H	1	noname	0.0757
17	H2    -1.6575     3.5173     0.9818	H	1	noname	0.0630
18	H3    -0.4378     4.4323     0.0634	H	1	noname	0.0630
19	H4    -0.2053    -0.9388     0.1235	H	1	noname	0.1333
20	H5     2.1758    -1.7302    -0.7914	H	1	noname	0.0291
21	H6     2.2012    -1.7092     0.9882	H	1	noname	0.0291
22	H7     3.4468    -0.8297     0.0699	H	1	noname	0.0291
23	H8     3.6926     2.4968     0.0272	H	1	noname	0.2184
24	H9    -3.8832     3.7657    -2.5493	H	1	noname	0.2283
25	H10    -1.7634     6.2811    -0.1938	H	1	noname	0.2283
@<TRIPOS>BOND
1	1	2	1
2	1	5	1
3	1	6	1
4	1	7	2
5	2	13	1
6	3	11	2
7	4	14	1
8	4	23	1
9	8	10	1
10	8	12	1
11	8	19	1
12	9	11	1
13	9	12	2
14	9	13	1
15	10	14	2
16	10	15	1
17	11	14	1
18	12	16	1
19	13	17	1
20	13	18	1
21	15	20	1
22	15	21	1
23	15	22	1
24	5	24	1
25	6	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1