@<TRIPOS>MOLECULE
DB02552
39 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     3.3039    -1.6612     0.3401	P	1	noname	0.0672
2	O1     3.9239    -2.9164     0.0029	O.2	1	noname	-0.1855
3	O2     4.0270    -0.5175    -0.3953	O.3	1	noname	-0.0279
4	O3     3.3979    -1.4343     1.8604	O.3	1	noname	-0.1446
5	O4     1.8238    -1.6894    -0.0841	O.3	1	noname	-0.1575
6	P2     3.9329    -0.7444    -1.9156	P	1	noname	0.0623
7	C1     2.7865    -0.1966     2.1930	C.3	1	noname	0.0809
8	O5     4.6090     0.3250    -2.6032	O.2	1	noname	-0.1871
9	O6     2.4528    -0.7727    -2.3398	O.3	1	noname	-0.1585
10	O7     4.5960    -2.0868    -2.2762	O.3	1	noname	-0.1585
11	C2     2.8739     0.0141     3.6047	C.2	1	noname	-0.0645
12	C3     2.3636     1.1170     4.1453	C.2	1	noname	-0.0692
13	C4     2.4509     1.3277     5.5569	C.3	1	noname	-0.0287
14	C5     1.7277     2.0921     3.3148	C.3	1	noname	-0.0438
15	C6     3.7458     2.0750     5.8819	C.3	1	noname	-0.0311
16	C7     3.8331     2.2857     7.2936	C.2	1	noname	-0.0837
17	C8     4.8828     2.9205     7.8076	C.2	1	noname	-0.0821
18	C9     4.9702     3.1312     9.2193	C.3	1	noname	-0.0442
19	C10     5.9242     3.3922     6.9485	C.3	1	noname	-0.0442
20	H1     1.2669    -1.7000     0.6978	H	1	noname	0.2283
21	H2     3.3821     0.5835     1.7187	H	1	noname	0.0622
22	H3     1.7281    -0.2963     1.9524	H	1	noname	0.0622
23	H4     1.8959    -0.7833    -1.5579	H	1	noname	0.2283
24	H5     4.8276    -2.5557    -1.4712	H	1	noname	0.2283
25	H6     3.3449    -0.6892     4.2914	H	1	noname	0.0599
26	H7     1.6148     1.9803     5.8081	H	1	noname	0.0315
27	H8     2.5177     0.3332     5.9981	H	1	noname	0.0315
28	H9     1.2400     2.8397     3.9404	H	1	noname	0.0276
29	H10     2.4745     2.5761     2.6855	H	1	noname	0.0276
30	H11     0.9836     1.6037     2.6855	H	1	noname	0.0276
31	H12     4.5820     1.4224     5.6307	H	1	noname	0.0313
32	H13     3.6790     3.0695     5.4408	H	1	noname	0.0313
33	H14     3.0745     1.9515     8.0013	H	1	noname	0.0575
34	H15     5.0017     2.1682     9.7291	H	1	noname	0.0276
35	H16     5.8760     3.6929     9.4475	H	1	noname	0.0276
36	H17     4.0994     3.6929     9.5573	H	1	noname	0.0276
37	H18     6.7511     3.7668     7.5518	H	1	noname	0.0276
38	H19     6.2748     2.5740     6.3194	H	1	noname	0.0276
39	H20     5.5403     4.1954     6.3194	H	1	noname	0.0276
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	4	7	1
7	6	8	2
8	6	9	1
9	6	10	1
10	7	11	1
11	11	12	2
12	12	13	1
13	12	14	1
14	13	15	1
15	15	16	1
16	16	17	2
17	17	18	1
18	17	19	1
19	5	20	1
20	7	21	1
21	7	22	1
22	9	23	1
23	10	24	1
24	11	25	1
25	13	26	1
26	13	27	1
27	14	28	1
28	14	29	1
29	14	30	1
30	15	31	1
31	15	32	1
32	16	33	1
33	18	34	1
34	18	35	1
35	18	36	1
36	19	37	1
37	19	38	1
38	19	39	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1