@<TRIPOS>MOLECULE
76968358
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -2.6276     4.7586    -0.9979	P	1	noname	0.0155
2	O1    -1.7549     3.4899    -1.0124	O.3	1	noname	-0.1511
3	O2     3.5516     1.3323    -0.0569	O.3	1	noname	-0.2717
4	O3     3.0562     3.7909    -0.6276	O.2	1	noname	-0.2995
5	O4    -3.5752     4.7437    -2.2118	O.3	1	noname	-0.1644
6	O5    -1.7243     6.0039    -1.0671	O.3	1	noname	-0.1644
7	O6    -3.4024     4.7945     0.2153	O.2	1	noname	-0.1965
8	N1     0.1863    -0.1145     0.1331	N.2	1	noname	-0.2389
9	C1    -0.0538     2.3008     0.0933	C.2	1	noname	0.0219
10	C2     1.3727     2.3861     0.0239	C.2	1	noname	0.0316
11	C3    -0.8812     3.5036     0.1070	C.3	1	noname	0.0898
12	C4     2.2075     1.2242     0.0090	C.2	1	noname	0.0572
13	C5     1.5691    -0.0603     0.0665	C.2	1	noname	0.0352
14	C6    -0.6449     0.9937     0.1490	C.2	1	noname	0.0020
15	C7     2.3619    -1.2862     0.0550	C.3	1	noname	0.0435
16	C8     1.9681     3.6409    -0.0309	C.2	1	noname	0.1060
17	H1    -1.4677     3.5308     1.0253	H	1	noname	0.0629
18	H2    -0.2418     4.3850     0.0580	H	1	noname	0.0629
19	H3    -1.6576     0.8831     0.1993	H	1	noname	0.0843
20	H4     2.0863    -1.8890    -0.8104	H	1	noname	0.0296
21	H5     2.1705    -1.8513     0.9672	H	1	noname	0.0296
22	H6     3.4207    -1.0336    -0.0006	H	1	noname	0.0296
23	H7     1.5171     4.4393     0.4158	H	1	noname	0.1099
24	H8     3.8772     1.8358     0.7182	H	1	noname	0.2183
25	H9    -3.7667     3.8356    -2.4572	H	1	noname	0.2283
26	H10    -1.5127     6.2956    -0.1773	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	11	1
6	3	12	1
7	3	24	1
8	4	16	2
9	8	13	2
10	8	14	1
11	9	10	1
12	9	11	1
13	9	14	2
14	10	12	2
15	10	16	1
16	11	17	1
17	11	18	1
18	12	13	1
19	13	15	1
20	14	19	1
21	15	20	1
22	15	21	1
23	15	22	1
24	16	23	1
25	5	25	1
26	6	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1