@<TRIPOS>MOLECULE
DB02765
25 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     4.4289    -1.3233     0.7514	O.3	1	noname	-0.3916
2	C1     3.6241    -0.9468    -0.3563	C.3	1	noname	0.0674
3	C2     2.1472    -1.1170     0.0051	C.3	1	noname	-0.0262
4	C3     3.8971     0.5163    -0.7110	C.3	1	noname	-0.0374
5	N1     1.3481    -0.7430    -1.0947	N.3	1	noname	0.0141
6	C4     0.8636     0.4865    -1.3581	C.2	1	noname	0.1222
7	C5     0.9185    -1.5457    -2.0897	C.2	1	noname	-0.0434
8	N2     1.0058     1.6591    -0.6683	N.2	1	noname	-0.2466
9	C6     0.1709     0.4078    -2.5714	C.2	1	noname	0.0222
10	N3     0.1736    -0.8626    -2.9877	N.2	1	noname	-0.2195
11	C7     0.4662     2.8105    -1.1862	C.2	1	noname	0.0498
12	C8    -0.3616     1.5957    -3.1235	C.2	1	noname	0.0722
13	N4    -0.1823     2.7502    -2.4048	N.2	1	noname	-0.2594
14	N5    -1.0117     1.5938    -4.2952	N.3	1	noname	-0.1031
15	H1     4.4691    -2.2809     0.8069	H	1	noname	0.2104
16	H2     3.9148    -1.6140    -1.1677	H	1	noname	0.0613
17	H3     1.9540    -2.1793     0.1541	H	1	noname	0.0500
18	H4     1.9057    -0.4034     0.7930	H	1	noname	0.0500
19	H5     4.0056     1.0979     0.2044	H	1	noname	0.0257
20	H6     4.8149     0.5834    -1.2951	H	1	noname	0.0257
21	H7     3.0651     0.9098    -1.2951	H	1	noname	0.0257
22	H8     1.1444    -2.6098    -2.1592	H	1	noname	0.1016
23	H9     0.5507     3.7513    -0.6422	H	1	noname	0.1062
24	H10    -2.0216     1.5931    -4.3125	H	1	noname	0.1258
25	H11    -0.4918     1.5931    -5.1612	H	1	noname	0.1258
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	1
5	5	6	1
6	5	7	1
7	6	8	2
8	6	9	1
9	7	10	2
10	8	11	1
11	9	12	2
12	9	10	1
13	11	13	2
14	12	14	1
15	12	13	1
16	1	15	1
17	2	16	1
18	3	17	1
19	3	18	1
20	4	19	1
21	4	20	1
22	4	21	1
23	7	22	1
24	11	23	1
25	14	24	1
26	14	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1