@<TRIPOS>MOLECULE
DB03216
28 30 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     5.5661    -1.5170    -0.6994	O.3	1	noname	-0.3861
2	C1     4.2260    -1.6015    -0.2374	C.3	1	noname	0.1003
3	C2     4.1109    -0.9215     1.0431	C.2	1	noname	-0.0580
4	C3     3.3186    -0.7274    -1.1284	C.3	1	noname	0.1060
5	C4     2.9627    -0.2541     1.1061	C.2	1	noname	-0.0600
6	O2     2.7902    -1.5165    -2.1841	O.3	1	noname	-0.3877
7	C5     2.2150    -0.4290    -0.1136	C.3	1	noname	0.0772
8	N1     1.2245     0.5578    -0.4301	N.3	1	noname	0.0171
9	C6     1.2345     1.8892    -0.2136	C.2	1	noname	0.1226
10	C7    -0.0211     0.2292    -0.8639	C.2	1	noname	-0.0415
11	N2     2.2221     2.7286     0.2423	N.2	1	noname	-0.2459
12	C8    -0.0626     2.3408    -0.4595	C.2	1	noname	0.0230
13	N3    -0.8106     1.3299    -0.8963	N.2	1	noname	-0.2189
14	C9     1.9268     4.0392     0.4906	C.2	1	noname	0.0499
15	C10    -0.3756     3.6853    -0.2014	C.2	1	noname	0.0724
16	N4     0.6435     4.4727     0.2695	N.2	1	noname	-0.2589
17	N5    -1.6068     4.1736    -0.4047	N.3	1	noname	-0.1031
18	H1     6.1620    -1.4794     0.0523	H	1	noname	0.2110
19	H2     4.0189    -2.6706    -0.1900	H	1	noname	0.0673
20	H3     4.8162    -0.9129     1.8742	H	1	noname	0.0601
21	H4     3.7665     0.1161    -1.6538	H	1	noname	0.0654
22	H5     2.6874     0.3248     1.9877	H	1	noname	0.0594
23	H6     2.8962    -2.4468    -1.9723	H	1	noname	0.2106
24	H7     1.4485    -1.1976    -0.0144	H	1	noname	0.0583
25	H8    -0.3412    -0.7739    -1.1457	H	1	noname	0.1016
26	H9     2.6949     4.7211     0.8555	H	1	noname	0.1062
27	H10    -1.7483     5.1707    -0.4813	H	1	noname	0.1258
28	H11    -2.3933     3.5445    -0.4813	H	1	noname	0.1258
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	2
5	4	6	1
6	4	7	1
7	5	7	1
8	7	8	1
9	8	9	1
10	8	10	1
11	9	11	2
12	9	12	1
13	10	13	2
14	11	14	1
15	12	15	2
16	12	13	1
17	14	16	2
18	15	17	1
19	15	16	1
20	1	18	1
21	2	19	1
22	3	20	1
23	4	21	1
24	5	22	1
25	6	23	1
26	7	24	1
27	10	25	1
28	14	26	1
29	17	27	1
30	17	28	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1