@<TRIPOS>MOLECULE
DB03552
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.5416    -2.6786     0.3330	O.2	1	noname	-0.2495
2	C1    -2.2958    -2.6589     0.2321	C.2	1	noname	0.1438
3	O2    -1.6441    -3.7192    -0.2908	O.3	1	noname	-0.2139
4	C2    -1.5456    -1.4891     0.6797	C.3	1	noname	0.0953
5	N1    -0.6107    -1.8832     1.7324	N.3	1	noname	-0.3191
6	C3    -0.7679    -0.9003    -0.4990	C.3	1	noname	-0.0029
7	C4    -0.0177     0.2695    -0.0514	C.2	1	noname	-0.0449
8	C5     1.2782     0.1220     0.4293	C.2	1	noname	-0.0277
9	C6    -0.5993     1.5308    -0.1059	C.2	1	noname	-0.0684
10	C7     1.9924     1.2357     0.8554	C.2	1	noname	-0.0008
11	C8     0.1149     2.6445     0.3202	C.2	1	noname	-0.0512
12	O3     3.2510     1.0924     1.3223	O.3	1	noname	-0.2859
13	C9     1.4108     2.4970     0.8009	C.2	1	noname	-0.0325
14	H1    -1.3060    -4.2692     0.4197	H	1	noname	0.2213
15	H2    -2.2519    -0.7735     1.1007	H	1	noname	0.0575
16	H3     0.3662    -2.0193     1.5151	H	1	noname	0.1191
17	H4    -0.9418    -2.0193     2.6768	H	1	noname	0.1191
18	H5    -0.0230    -1.6360    -0.8023	H	1	noname	0.0337
19	H6    -1.4953    -0.5313    -1.2220	H	1	noname	0.0337
20	H7     1.7343    -0.8671     0.4721	H	1	noname	0.0652
21	H8    -1.6155     1.6465    -0.4828	H	1	noname	0.0625
22	H9    -0.3412     3.6336     0.2775	H	1	noname	0.0623
23	H10     3.2383     1.0938     2.2822	H	1	noname	0.2181
24	H11     1.9708     3.3703     1.1351	H	1	noname	0.0650
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	7	8	2
8	7	9	1
9	8	10	1
10	9	11	2
11	10	12	1
12	10	13	2
13	11	13	1
14	3	14	1
15	4	15	1
16	5	16	1
17	5	17	1
18	6	18	1
19	6	19	1
20	8	20	1
21	9	21	1
22	11	22	1
23	12	23	1
24	13	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1