@<TRIPOS>MOLECULE
85315
40 42
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     5.9334     1.0662     3.5538	P
2	P2     7.6324    -0.2777     5.1411	P
3	O1     2.4833     1.4858     1.2087	O
4	O2     1.4352     1.0303    -2.1974	O
5	O3     2.3698    -1.1755    -0.8855	O
6	O4     4.7026     0.7602     2.7092	O
7	O5     6.5776    -0.2267     4.0127	O
8	O6     6.9356     1.8478     2.7357	O	1	noname	-1
9	O7     5.5334     1.8588     4.7357	O
10	O8     7.1425     0.2672     6.5042	O
11	O9     8.8478     0.5133     4.6785	O	1	noname	-1
12	O10     8.0457    -1.6868     5.3163	O
13	N1     1.7563     3.3738    -0.0160	N
14	N2     2.4142     5.4985     0.2368	N
15	N3    -0.2398     3.8651    -1.3767	N
16	N4    -0.5615     6.1714    -1.7959	N
17	N5     0.9079     7.7663    -0.9747	N
18	C1     2.4021     1.2909    -1.1763	C
19	C2     3.0976     0.0270    -0.6228	C
20	C3     1.7499     1.9368     0.0629	C
21	C4     3.2100     0.2883     0.9041	C
22	C5     4.6707     0.4572     1.4023	C
23	C6     0.8784     4.1600    -0.6622	C
24	C7     2.6779     4.2097     0.5206	C
25	C8     1.2969     5.4760    -0.5006	C
26	C9     0.5519     6.5116    -1.0901	C
27	C10    -0.9590     4.8739    -1.9415	C
28	H1     3.1646     1.9570    -1.5928	H
29	H2     4.0795    -0.0869    -1.0922	H
30	H3     0.7225     1.5746     0.1804	H
31	H4     2.7463    -0.5319     1.4612	H
32	H5     5.1395     1.2596     0.8235	H
33	H6     5.2184    -0.4726     1.2224	H
34	H7     1.1454     1.8976    -2.5515	H
35	H8     2.8605    -1.9070    -0.4528	H
36	H9     3.4871     3.9136     1.0703	H
37	H10    -1.8004     4.6605    -2.4779	H
38	H11     1.6743     7.9944    -0.4890	H
39	H12     0.3978     8.4379    -1.3789	H
40	H13     7.5632     0.0280     7.2437	H
@<TRIPOS>BOND
1	1	6	1
2	1	7	1
3	1	8	1
4	1	9	2
5	2	7	1
6	2	10	1
7	2	11	1
8	2	12	2
9	3	20	1
10	3	21	1
11	18	4	1
12	4	34	1
13	19	5	1
14	5	35	1
15	6	22	1
16	10	40	1
17	20	13	1
18	13	23	1
19	13	24	1
20	14	24	2
21	14	25	1
22	15	23	1
23	15	27	2
24	16	26	2
25	16	27	1
26	17	26	1
27	17	38	1
28	17	39	1
29	18	19	1
30	18	20	1
31	18	28	1
32	19	21	1
33	19	29	1
34	20	30	1
35	21	22	1
36	21	31	1
37	22	32	1
38	22	33	1
39	23	25	2
40	24	36	1
41	25	26	1
42	27	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1