@<TRIPOS>MOLECULE
72941846
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -2.7568     4.8205    -0.7344	P	1	noname	0.0155
2	O1    -1.8745     3.5617    -0.8273	O.3	1	noname	-0.1511
3	O2     3.4812     1.4224    -0.1443	O.3	1	noname	-0.2717
4	O3     2.9447     3.8954    -0.6050	O.2	1	noname	-0.2995
5	O4    -3.7476     4.8410    -1.9131	O.3	1	noname	-0.1644
6	O5    -1.8671     6.0762    -0.7897	O.3	1	noname	-0.1644
7	O6    -3.4873     4.8041     0.5065	O.2	1	noname	-0.1965
8	N1     0.1374    -0.0632     0.1128	N.2	1	noname	-0.2389
9	C1    -0.1244     2.3494     0.1714	C.2	1	noname	0.0219
10	C2     1.2979     2.4511     0.0540	C.2	1	noname	0.0316
11	C3    -0.9608     3.5428     0.2596	C.3	1	noname	0.0898
12	C4     2.1414     1.2988    -0.0341	C.2	1	noname	0.0572
13	C5     1.5163     0.0069    -0.0015	C.2	1	noname	0.0352
14	C6    -0.7020     1.0355     0.1998	C.2	1	noname	0.0020
15	C7     2.3185    -1.2100    -0.0871	C.3	1	noname	0.0435
16	C8     1.8803     3.7129     0.0245	C.2	1	noname	0.1060
17	H1    -1.5138     3.5303     1.1988	H	1	noname	0.0629
18	H2    -0.3311     4.4316     0.2204	H	1	noname	0.0629
19	H3    -1.7113     0.9131     0.2823	H	1	noname	0.0843
20	H4     2.0167    -1.7831    -0.9638	H	1	noname	0.0296
21	H5     2.1651    -1.8101     0.8098	H	1	noname	0.0296
22	H6     3.3725    -0.9452    -0.1713	H	1	noname	0.0296
23	H7     1.4391     4.4899     0.5165	H	1	noname	0.1099
24	H8     3.8305     1.9002     0.6368	H	1	noname	0.2183
25	H9    -3.2505     4.8522    -2.7576	H	1	noname	0.2283
26	H10    -1.3699     6.0874    -1.6342	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	5	25	1
10	6	26	1
11	8	13	2
12	8	14	1
13	9	10	1
14	9	11	1
15	9	14	2
16	10	12	2
17	10	16	1
18	11	17	1
19	11	18	1
20	12	13	1
21	13	15	1
22	14	19	1
23	15	20	1
24	15	21	1
25	15	22	1
26	16	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1