@<TRIPOS>MOLECULE
DB04294
37 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -3.8657    -2.0613     3.0132	P	1	noname	0.0149
2	O1    -4.4753    -1.9361     4.3118	O.2	1	noname	-0.1967
3	O2    -2.8441    -0.9250     2.8135	O.3	1	noname	-0.1525
4	O3    -3.1483    -3.4202     2.9118	O.3	1	noname	-0.1645
5	O4    -4.9521    -1.9720     1.9253	O.3	1	noname	-0.1645
6	C1    -2.2975    -1.1308     1.5116	C.3	1	noname	0.0915
7	C2    -1.1059    -0.1818     1.3165	C.3	1	noname	0.1138
8	O5     0.0764    -0.6909     1.9347	O.3	1	noname	-0.3405
9	C3    -0.6478     0.1144    -0.1142	C.3	1	noname	0.1135
10	C4     1.0483     0.3184     1.6276	C.3	1	noname	0.1988
11	O6    -1.5070     1.0456    -0.7816	O.3	1	noname	-0.3873
12	C5     0.7785     0.6525     0.1349	C.3	1	noname	0.1341
13	O7     0.9011     1.4903     2.4428	O.3	1	noname	-0.1568
14	O8     0.9989     2.0097    -0.2450	O.3	1	noname	-0.3849
15	P2     1.1529     1.3344     4.0264	P	1	noname	0.0351
16	O9     1.2587     2.7240     4.5199	O.2	1	noname	-0.2234
17	O10     2.5749     0.6603     4.2822	O.3	1	noname	-0.1895
18	C6    -0.1267     0.5153     4.8674	C.3	1	noname	0.1617
19	P3    -0.1074    -1.1426     4.8850	P	1	noname	0.0206
20	O11    -1.2424    -1.6280     5.6265	O.2	1	noname	-0.2270
21	O12     1.1904    -1.6338     5.5529	O.3	1	noname	-0.1918
22	O13    -0.1735    -1.6720     3.4404	O.3	1	noname	-0.1918
23	H1    -2.9714    -3.7553     3.7939	H	1	noname	0.2283
24	H2    -5.8150    -1.9010     2.3399	H	1	noname	0.2283
25	H3    -1.9204    -2.1535     1.5098	H	1	noname	0.0605
26	H4    -3.0821    -0.8380     0.8140	H	1	noname	0.0605
27	H5    -1.4577     0.7292     1.8005	H	1	noname	0.0657
28	H6    -0.7245    -0.7088    -0.8245	H	1	noname	0.0658
29	H7     2.0438    -0.0376     1.8931	H	1	noname	0.0960
30	H8    -1.9850     1.5638    -0.1300	H	1	noname	0.2106
31	H9     1.5271     0.2646    -0.5560	H	1	noname	0.0683
32	H10     1.0869     2.5521     0.5422	H	1	noname	0.2108
33	H11     2.7291     0.5872     5.2269	H	1	noname	0.2259
34	H12    -0.0189     0.7906     5.9165	H	1	noname	0.0572
35	H13    -1.0427     0.7619     4.3306	H	1	noname	0.0572
36	H14     1.0929    -1.5969     6.5072	H	1	noname	0.2259
37	H15    -0.1730    -2.6320     3.4511	H	1	noname	0.2259
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	7	6	1
7	7	8	1
8	7	9	1
9	8	10	1
10	9	11	1
11	9	12	1
12	10	13	1
13	10	12	1
14	12	14	1
15	13	15	1
16	15	16	2
17	15	17	1
18	15	18	1
19	18	19	1
20	19	20	2
21	19	21	1
22	19	22	1
23	4	23	1
24	5	24	1
25	6	25	1
26	6	26	1
27	7	27	1
28	9	28	1
29	10	29	1
30	11	30	1
31	12	31	1
32	14	32	1
33	17	33	1
34	18	34	1
35	18	35	1
36	21	36	1
37	22	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1