@<TRIPOS>MOLECULE
DB04260
36 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     6.3811    -4.4665     2.9790	P	1	noname	0.0475
2	O1     6.4514    -5.8466     3.3837	O.2	1	noname	-0.2108
3	O2     6.2948    -3.5691     4.2276	O.3	1	noname	-0.1794
4	O3     7.6414    -4.1033     2.1720	O.3	1	noname	-0.1794
5	C1     5.0426    -4.2355     2.0422	C.3	1	noname	0.3501
6	F1     5.1194    -5.0344     0.9307	F	1	noname	-0.1902
7	F2     3.9206    -4.5588     2.7607	F	1	noname	-0.1902
8	C2     4.9679    -2.7691     1.6122	C.3	1	noname	0.0253
9	C3     3.7267    -2.5550     0.7435	C.3	1	noname	-0.0452
10	C4     3.6520    -1.0885     0.3135	C.3	1	noname	-0.0367
11	C5     2.4109    -0.8744    -0.5552	C.3	1	noname	-0.0386
12	N1     2.3420     0.4770    -0.9515	N.3	1	noname	0.0134
13	C6     1.7245     1.4790    -0.2953	C.2	1	noname	0.0324
14	C7     2.8813     1.0206    -2.0616	C.2	1	noname	-0.0272
15	N2     1.0278     1.4676     0.8817	N.2	1	noname	-0.2053
16	C8     1.9535     2.6530    -1.0216	C.2	1	noname	0.0936
17	N3     2.6293     2.3470    -2.1337	N.2	1	noname	-0.1999
18	C9     0.5454     2.6500     1.3860	C.2	1	noname	-0.0774
19	C10     1.4841     3.8772    -0.4920	C.2	1	noname	0.0882
20	N4     0.8039     3.8199     0.6978	N.3	1	noname	0.0507
21	N5    -0.1624     2.6691     2.5237	N.3	1	noname	-0.1233
22	O4     1.6800     4.9621    -1.0812	O.2	1	noname	-0.2752
23	H1     6.2406    -4.1182     5.0132	H	1	noname	0.2261
24	H2     8.3591    -3.8966     2.7751	H	1	noname	0.2261
25	H3     4.8223    -2.1823     2.5191	H	1	noname	0.0337
26	H4     5.8332    -2.5833     0.9759	H	1	noname	0.0337
27	H5     3.8724    -3.1418    -0.1634	H	1	noname	0.0269
28	H6     2.8615    -2.7408     1.3798	H	1	noname	0.0269
29	H7     3.5064    -0.5017     1.2204	H	1	noname	0.0283
30	H8     4.5173    -0.9028    -0.3228	H	1	noname	0.0283
31	H9     2.5406    -1.4395    -1.4782	H	1	noname	0.0473
32	H10     1.5297    -1.0384     0.0650	H	1	noname	0.0473
33	H11     3.4481     0.4601    -2.8051	H	1	noname	0.1016
34	H12     0.4739     4.6902     1.0901	H	1	noname	0.1400
35	H13     0.3136     2.6763     3.4145	H	1	noname	0.1268
36	H14    -1.1718     2.6763     2.4904	H	1	noname	0.1268
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	5	6	1
6	5	7	1
7	5	8	1
8	8	9	1
9	9	10	1
10	10	11	1
11	11	12	1
12	12	13	1
13	12	14	1
14	13	15	1
15	13	16	2
16	14	17	2
17	15	18	2
18	16	19	1
19	16	17	1
20	18	20	1
21	18	21	1
22	19	22	2
23	19	20	1
24	3	23	1
25	4	24	1
26	8	25	1
27	8	26	1
28	9	27	1
29	9	28	1
30	10	29	1
31	10	30	1
32	11	31	1
33	11	32	1
34	14	33	1
35	20	34	1
36	21	35	1
37	21	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1