@<TRIPOS>MOLECULE
85315
40 42
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     5.8860     1.0867     3.4481	P
2	P2     7.3245    -0.7560     4.7567	P
3	O1     3.8340     1.1279    -0.3563	O
4	O2     2.1307    -1.2995    -2.3508	O
5	O3     1.3554    -1.1666     0.2653	O
6	O4     4.8398     1.1325     2.3407	O
7	O5     6.2828    -0.3558     3.6992	O
8	O6     7.1171     1.8537     3.0355	O	1	noname	-1
9	O7     5.3539     1.6675     4.6966	O
10	O8     7.9568     0.4250     5.5279	O
11	O9     8.4224    -1.5110     4.0332	O	1	noname	-1
12	O10     6.6723    -1.6804     5.7106	O
13	N1     4.7706     0.6251    -2.4610	N
14	N2     6.0847     0.7118    -4.2641	N
15	N3     6.5831     0.5443    -0.7982	N
16	N4     8.7480     0.6154    -1.7320	N
17	N5     9.0664     0.7245    -4.0235	N
18	C1     3.1660    -0.9284    -1.4386	C
19	C2     2.7569    -1.0129     0.0453	C
20	C3     3.5938     0.5405    -1.6417	C
21	C4     3.2695     0.3114     0.6739	C
22	C5     4.3315     0.0340     1.7621	C
23	C6     6.0488     0.6074    -2.0438	C
24	C7     4.8155     0.6861    -3.8106	C
25	C8     6.8592     0.6638    -3.1702	C
26	C9     8.2533     0.6689    -3.0014	C
27	C10     7.9337     0.5482    -0.6406	C
28	H1     4.0146    -1.6011    -1.6072	H
29	H2     3.2344    -1.8935     0.4895	H
30	H3     2.7767     1.1088    -2.0993	H
31	H4     2.4431     0.8714     1.1219	H
32	H5     3.8606    -0.5928     2.5275	H
33	H6     5.1445    -0.5355     1.2983	H
34	H7     2.5215    -1.2776    -3.2497	H
35	H8     1.2289    -1.1798     1.2390	H
36	H9     3.9961     0.7042    -4.4219	H
37	H10     8.3343     0.5007     0.2968	H
38	H11     8.7349     0.6166    -4.8913	H
39	H12     9.9795     0.8721    -3.8882	H
40	H13     8.5564     0.2379     6.1477	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