@<TRIPOS>MOLECULE
DB03315
38 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     7.1285    -1.7087     0.5488	P	1	noname	0.0165
2	O1     7.9483    -2.0140     1.6926	O.2	1	noname	-0.1963
3	O2     5.6952    -1.3918     1.0144	O.3	1	noname	-0.1482
4	O3     7.1033    -2.9193    -0.4026	O.3	1	noname	-0.1643
5	O4     7.7103    -0.4883    -0.1886	O.3	1	noname	-0.1643
6	C1     4.8868    -1.0907    -0.1135	C.3	1	noname	0.1318
7	C2     3.4765    -0.7790     0.3446	C.3	1	noname	0.1271
8	C3     5.3207     0.2574    -0.7094	C.3	1	noname	0.1130
9	O5     3.1731    -1.5476     1.4994	O.3	1	noname	-0.3856
10	C4     3.6393     0.6848     0.7369	C.3	1	noname	0.1590
11	O6     4.3501     1.2490    -0.3646	O.3	1	noname	-0.3483
12	C5     5.4084     0.1374    -2.2322	C.3	1	noname	0.0722
13	N1     2.3897     1.2903     1.0265	N.3	1	noname	0.0264
14	O7     5.8094     1.3833    -2.7828	O.3	1	noname	-0.3934
15	C6     1.5287     1.8686     0.1698	C.2	1	noname	0.0402
16	C7     1.8217     1.2977     2.2546	C.2	1	noname	-0.0199
17	N2     1.6363     2.1151    -1.1721	N.2	1	noname	-0.2033
18	C8     0.3914     2.1883     0.9196	C.2	1	noname	0.0955
19	N3     0.5829     1.8460     2.1954	N.2	1	noname	-0.1979
20	C9     0.5821     2.6872    -1.8266	C.2	1	noname	-0.0771
21	C10    -0.6976     2.7747     0.2352	C.2	1	noname	0.0884
22	N4    -0.5478     2.9927    -1.1154	N.3	1	noname	0.0507
23	N5     0.6525     2.9445    -3.1398	N.3	1	noname	-0.1233
24	O8    -1.7523     3.0822     0.8316	O.2	1	noname	-0.2752
25	H1     7.0865    -3.7300     0.1114	H	1	noname	0.2283
26	H2     8.0176     0.1565     0.4528	H	1	noname	0.2283
27	H3     4.9951    -1.9672    -0.7523	H	1	noname	0.0671
28	H4     2.6700    -1.0224    -0.3471	H	1	noname	0.0674
29	H5     6.2671     0.6000    -0.2910	H	1	noname	0.0657
30	H6     3.2292    -2.4819     1.2857	H	1	noname	0.2107
31	H7     4.1762     0.9097     1.6585	H	1	noname	0.0853
32	H8     6.2131    -0.5582    -2.4702	H	1	noname	0.0591
33	H9     4.4035    -0.0399    -2.6153	H	1	noname	0.0591
34	H10     6.0073     1.9982    -2.0727	H	1	noname	0.2101
35	H11     2.2938     0.9171     3.1603	H	1	noname	0.1016
36	H12    -1.3199     3.4053    -1.6192	H	1	noname	0.1400
37	H13    -0.1944     3.0415    -3.6815	H	1	noname	0.1268
38	H14     1.5525     3.0415    -3.5879	H	1	noname	0.1268
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	6	3	1
6	6	7	1
7	6	8	1
8	7	9	1
9	7	10	1
10	8	11	1
11	8	12	1
12	10	13	1
13	10	11	1
14	12	14	1
15	13	15	1
16	13	16	1
17	15	17	1
18	15	18	2
19	16	19	2
20	17	20	2
21	18	21	1
22	18	19	1
23	20	22	1
24	20	23	1
25	21	24	2
26	21	22	1
27	4	25	1
28	5	26	1
29	6	27	1
30	7	28	1
31	8	29	1
32	9	30	1
33	10	31	1
34	12	32	1
35	12	33	1
36	14	34	1
37	16	35	1
38	22	36	1
39	23	37	1
40	23	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1