@<TRIPOS>MOLECULE
DB03787
36 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     2.6188    -0.7835     4.5144	P	1	noname	0.0155
2	O1     2.8336    -2.0586     5.1480	O.2	1	noname	-0.1965
3	O2     1.6288    -0.9507     3.3468	O.3	1	noname	-0.1511
4	O3     3.9582    -0.2445     3.9785	O.3	1	noname	-0.1644
5	O4     2.0399     0.2085     5.5403	O.3	1	noname	-0.1644
6	C1     1.4170     0.3067     2.7219	C.3	1	noname	0.0895
7	C2     0.4784     0.1482     1.6149	C.2	1	noname	-0.0023
8	C3     0.9206    -0.1528     0.2876	C.2	1	noname	0.0106
9	C4    -0.9210     0.2839     1.7960	C.2	1	noname	-0.0055
10	C5     0.0667    -0.3126    -0.8493	C.2	1	noname	0.0344
11	C6     2.3663    -0.2243     0.1197	C.3	1	noname	0.0677
12	N1    -1.7299     0.1183     0.6836	N.2	1	noname	-0.2527
13	O5     0.5551    -0.5875    -2.0775	O.3	1	noname	-0.2759
14	C7    -1.3316    -0.1642    -0.6079	C.2	1	noname	0.0281
15	N2     2.9026    -1.4946     0.2241	N.2	1	noname	-0.2280
16	C8    -2.3053    -0.3059    -1.6865	C.3	1	noname	0.0428
17	C9     4.1379    -1.7420    -0.0188	C.2	1	noname	0.0906
18	C10     5.1422    -0.9737    -0.3978	C.2	1	noname	0.0780
19	C11     4.6557    -3.0386    -0.1059	C.3	1	noname	0.1233
20	O6     5.3051     0.3052    -0.1144	O.3	1	noname	-0.2414
21	N3     5.9238    -1.7036    -1.0894	N.2	1	noname	-0.1560
22	O7     5.4999    -2.8876    -1.2506	O.3	1	noname	-0.1818
23	H1     4.5287    -0.0150     4.7157	H	1	noname	0.2283
24	H2     2.2235    -0.1061     6.4285	H	1	noname	0.2283
25	H3     0.9352     0.9408     3.4662	H	1	noname	0.0629
26	H4     2.3753     0.6007     2.2937	H	1	noname	0.0629
27	H5    -1.3638     0.5099     2.7660	H	1	noname	0.0843
28	H6     2.5764     0.0784    -0.9061	H	1	noname	0.0566
29	H7     2.8045     0.3274     0.9514	H	1	noname	0.0566
30	H8     0.6027    -1.5388    -2.1974	H	1	noname	0.2182
31	H9    -2.4807    -1.3640    -1.8809	H	1	noname	0.0296
32	H10    -3.2416     0.1702    -1.3956	H	1	noname	0.0296
33	H11    -1.9204     0.1702    -2.5883	H	1	noname	0.0296
34	H12     5.2750    -3.2230     0.7719	H	1	noname	0.0664
35	H13     3.8412    -3.7202    -0.3512	H	1	noname	0.0664
36	H14     5.3200     0.4225     0.8383	H	1	noname	0.2200
@<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	2
8	7	9	1
9	8	10	1
10	8	11	1
11	9	12	2
12	10	13	1
13	10	14	2
14	11	15	1
15	12	14	1
16	14	16	1
17	15	17	2
18	17	18	1
19	17	19	1
20	18	20	1
21	18	21	2
22	19	22	1
23	21	22	1
24	4	23	1
25	5	24	1
26	6	25	1
27	6	26	1
28	9	27	1
29	11	28	1
30	11	29	1
31	13	30	1
32	16	31	1
33	16	32	1
34	16	33	1
35	19	34	1
36	19	35	1
37	20	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1