@<TRIPOS>MOLECULE
DB02928
27 27 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -3.5558    -2.7504     0.3206	O.2	1	noname	-0.2495
2	C1    -2.3074    -2.7180     0.2668	C.2	1	noname	0.1439
3	O2    -1.6237    -3.7860    -0.1963	O.3	1	noname	-0.2139
4	C2    -1.5886    -1.5250     0.7047	C.3	1	noname	0.0954
5	N1    -0.6905    -1.8733     1.8045	N.3	1	noname	-0.3191
6	C3    -0.7727    -0.9642    -0.4619	C.3	1	noname	-0.0004
7	C4    -0.0540     0.2288    -0.0240	C.2	1	noname	-0.0399
8	C5     1.2240     0.1132     0.5104	C.2	1	noname	-0.0225
9	C6    -0.6476     1.4801    -0.1414	C.2	1	noname	-0.0463
10	O3     1.8006    -1.1021     0.6245	O.3	1	noname	-0.2876
11	C7     1.9083     1.2490     0.9273	C.2	1	noname	-0.0072
12	C8     0.0367     2.6159     0.2755	C.2	1	noname	-0.0200
13	C9     1.3146     2.5004     0.8099	C.2	1	noname	-0.0060
14	N2    -0.5356     3.8223     0.1622	N.3	1	noname	-0.1465
15	O4     1.9793     3.6035     1.2148	O.3	1	noname	-0.2821
16	H1    -1.2943    -4.3006     0.5442	H	1	noname	0.2213
17	H2    -2.3188    -0.8054     1.0750	H	1	noname	0.0575
18	H3     0.2972    -1.9937     1.6311	H	1	noname	0.1191
19	H4    -1.0578    -1.9937     2.7376	H	1	noname	0.1191
20	H5    -0.0083    -1.6996    -0.7125	H	1	noname	0.0338
21	H6    -1.4759    -0.6277    -1.2237	H	1	noname	0.0338
22	H7    -1.6498     1.5708    -0.5605	H	1	noname	0.0644
23	H8     1.9044    -1.3211     1.5534	H	1	noname	0.2182
24	H9     2.9104     1.1584     1.3464	H	1	noname	0.0678
25	H10     0.0390     4.6518     0.1195	H	1	noname	0.1243
26	H11    -1.5415     3.9020     0.1195	H	1	noname	0.1243
27	H12     1.9967     3.6324     2.1742	H	1	noname	0.2182
@<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	8	11	1
11	9	12	2
12	11	13	2
13	12	14	1
14	12	13	1
15	13	15	1
16	3	16	1
17	4	17	1
18	5	18	1
19	5	19	1
20	6	20	1
21	6	21	1
22	9	22	1
23	10	23	1
24	11	24	1
25	14	25	1
26	14	26	1
27	15	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1