@<TRIPOS>MOLECULE
DB03887
37 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     5.8090     0.5767     2.3322	P	1	noname	0.0149
2	O1     5.9998     0.5077     3.7578	O.2	1	noname	-0.1967
3	O2     4.8245    -0.5227     1.8922	O.3	1	noname	-0.1525
4	O3     5.2384     1.9570     1.9568	O.3	1	noname	-0.1645
5	O4     7.1602     0.3697     1.6228	O.3	1	noname	-0.1645
6	C1     4.6364    -0.4547     0.4864	C.3	1	noname	0.0914
7	C2     3.6582    -1.5469     0.0493	C.3	1	noname	0.1130
8	O5     2.4129    -1.3561     0.7030	O.3	1	noname	-0.3483
9	C3     3.4107    -1.4371    -1.4568	C.3	1	noname	0.1127
10	C4     1.8394    -0.3298    -0.0896	C.3	1	noname	0.1579
11	O6     3.3580    -2.7378    -2.0240	O.3	1	noname	-0.3873
12	C5     2.0282    -0.7916    -1.5338	C.3	1	noname	0.1257
13	N1     0.4838    -0.1272     0.2853	N.3	1	noname	-0.0011
14	O7     1.0597    -1.7827    -1.8443	O.3	1	noname	-0.3857
15	C6    -0.5000    -1.0461     0.3191	C.2	1	noname	0.0407
16	C7    -0.0184     1.0290     0.7700	C.2	1	noname	-0.0185
17	C8    -0.5913    -2.4121    -0.0508	C.2	1	noname	0.0476
18	C9    -1.6271    -0.4351     0.8623	C.2	1	noname	0.0965
19	N2    -1.3151     0.8423     1.1241	N.2	1	noname	-0.1883
20	N3    -1.7809    -3.0493     0.1610	N.2	1	noname	-0.2397
21	N4     0.4534    -3.0556    -0.5895	N.3	1	noname	-0.1094
22	N5    -2.8006    -1.1106     1.0619	N.2	1	noname	-0.2194
23	C10    -2.8774    -2.4369     0.7116	C.2	1	noname	0.0329
24	H1     5.0356     2.4477     2.7566	H	1	noname	0.2283
25	H2     7.8530     0.2635     2.2788	H	1	noname	0.2283
26	H3     4.1675     0.5119     0.3022	H	1	noname	0.0605
27	H4     5.6102    -0.6797     0.0515	H	1	noname	0.0605
28	H5     4.0221    -2.5316     0.3428	H	1	noname	0.0657
29	H6     4.1929    -0.9331    -2.0245	H	1	noname	0.0657
30	H7     2.2876     0.6416     0.1194	H	1	noname	0.0852
31	H8     3.3315    -3.3922    -1.3220	H	1	noname	0.2106
32	H9     1.8839    -0.0393    -2.3092	H	1	noname	0.0674
33	H10     0.7032    -2.1475    -1.0310	H	1	noname	0.2107
34	H11     0.5347     1.9638     0.8608	H	1	noname	0.1017
35	H12     0.3883    -4.0428    -0.7925	H	1	noname	0.1258
36	H13     1.3058    -2.5534    -0.7925	H	1	noname	0.1258
37	H14    -3.7988    -2.9976     0.8688	H	1	noname	0.1062
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	7	6	1
7	7	8	1
8	7	9	1
9	8	10	1
10	9	11	1
11	9	12	1
12	10	13	1
13	10	12	1
14	12	14	1
15	13	15	1
16	13	16	1
17	15	17	2
18	15	18	1
19	16	19	2
20	17	20	1
21	17	21	1
22	18	22	2
23	18	19	1
24	20	23	2
25	22	23	1
26	4	24	1
27	5	25	1
28	6	26	1
29	6	27	1
30	7	28	1
31	9	29	1
32	10	30	1
33	11	31	1
34	12	32	1
35	14	33	1
36	16	34	1
37	21	35	1
38	21	36	1
39	23	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1