@<TRIPOS>MOLECULE
71587802
38 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -3.2348     0.8739     4.6774	P	1	noname	0.0146
2	O1     1.9908     2.9250     1.1054	O.3	1	noname	-0.3874
3	O2     3.5574    -0.4570     0.7953	O.3	1	noname	-0.3869
4	O3     4.3339     3.4404     2.6025	O.3	1	noname	-0.3878
5	O4     1.4780    -1.3684    -0.1812	O.3	1	noname	-0.3809
6	O5     5.6454     1.3755     4.0711	O.3	1	noname	-0.3934
7	O6    -0.5168     0.2684    -1.1371	O.2	1	noname	-0.2858
8	O7    -3.1060     1.3361     3.1644	O.3	1	noname	-0.1536
9	O8    -4.7103     1.1972     5.1471	O.3	1	noname	-0.1646
10	O9    -2.2518     1.7200     5.5842	O.3	1	noname	-0.1646
11	O10    -2.9837    -0.5702     4.8356	O.2	1	noname	-0.1967
12	N1    -0.2643     1.1903     0.9509	N.3	1	noname	-0.0685
13	C1     3.0152     1.9128     1.2042	C.3	1	noname	0.1111
14	C2     2.4709     0.4391     1.0695	C.3	1	noname	0.1169
15	C3     3.7487     2.1402     2.5809	C.3	1	noname	0.1056
16	C4     1.5922     0.0657    -0.1380	C.3	1	noname	0.1555
17	C5     4.8870     1.1304     2.8887	C.3	1	noname	0.0718
18	C6     0.1979     0.5418    -0.1358	C.2	1	noname	0.0536
19	C7    -1.6076     1.4812     1.2483	C.3	1	noname	0.0273
20	C8    -1.7836     1.0699     2.7091	C.3	1	noname	0.0754
21	H1     3.7187     2.1050     0.3905	H	1	noname	0.0657
22	H2     1.9801     0.1661     2.0167	H	1	noname	0.0661
23	H3     3.0148     2.0698     3.3932	H	1	noname	0.0652
24	H4     2.1057     0.3911    -1.0526	H	1	noname	0.0727
25	H5     4.4450     0.1650     3.1314	H	1	noname	0.0591
26	H6     5.5325     1.0487     2.0088	H	1	noname	0.0591
27	H7     1.6099     2.8300     0.2098	H	1	noname	0.2106
28	H8     4.2163    -0.3304     1.4638	H	1	noname	0.2107
29	H9     0.3886     1.4389     1.6177	H	1	noname	0.1311
30	H10    -2.2587     0.8744     0.6190	H	1	noname	0.0457
31	H11    -1.8360     2.5453     1.1881	H	1	noname	0.0457
32	H12     3.6328     4.1161     2.4918	H	1	noname	0.2106
33	H13     1.0657    -1.6885     0.6482	H	1	noname	0.2112
34	H14    -1.5699     0.0063     2.8153	H	1	noname	0.0590
35	H15    -1.1036     1.6319     3.3492	H	1	noname	0.0590
36	H16     6.0744     2.2543     4.0076	H	1	noname	0.2101
37	H17    -4.8749     2.1600     5.0672	H	1	noname	0.2283
38	H18    -2.4808     2.6704     5.5157	H	1	noname	0.2283
@<TRIPOS>BOND
1	1	8	1
2	1	9	1
3	1	10	1
4	1	11	2
5	13	2	1
6	2	27	1
7	14	3	1
8	3	28	1
9	15	4	1
10	4	32	1
11	16	5	1
12	5	33	1
13	6	17	1
14	6	36	1
15	7	18	2
16	8	20	1
17	9	37	1
18	10	38	1
19	12	18	1
20	12	19	1
21	12	29	1
22	13	14	1
23	13	15	1
24	13	21	1
25	14	16	1
26	14	22	1
27	15	17	1
28	15	23	1
29	16	18	1
30	16	24	1
31	17	25	1
32	17	26	1
33	19	20	1
34	19	30	1
35	19	31	1
36	20	34	1
37	20	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1