@<TRIPOS>MOLECULE
DB04311
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -5.1955    -2.5679     1.5196	N.3	1	noname	-0.3304
2	C1    -4.2779    -1.4549     1.2814	C.3	1	noname	-0.0076
3	C2    -3.0013    -1.9789     0.6207	C.3	1	noname	-0.0406
4	C3    -2.0410    -0.8142     0.3714	C.3	1	noname	-0.0480
5	C4    -0.7644    -1.3382    -0.2893	C.3	1	noname	0.0053
6	C5     0.1520    -0.2267    -0.5272	C.2	1	noname	-0.0579
7	C6     1.0792     0.1299     0.4451	C.2	1	noname	-0.0653
8	C7     0.0972     0.4748    -1.7259	C.2	1	noname	-0.0653
9	C8     1.9516     1.1880     0.2186	C.2	1	noname	-0.0635
10	C9     0.9696     1.5329    -1.9524	C.2	1	noname	-0.0635
11	C10     1.8968     1.8896    -0.9802	C.2	1	noname	-0.0696
12	H1    -6.1874    -2.3959     1.6019	H	1	noname	0.1184
13	H2    -4.8376    -3.5087     1.6019	H	1	noname	0.1184
14	H3    -4.7761    -0.8035     0.5634	H	1	noname	0.0425
15	H4    -4.0061    -1.0739     2.2658	H	1	noname	0.0425
16	H5    -2.5187    -2.6351     1.3450	H	1	noname	0.0279
17	H6    -3.2887    -2.3646    -0.3574	H	1	noname	0.0279
18	H7    -2.5236    -0.1580    -0.3529	H	1	noname	0.0270
19	H8    -1.7536    -0.4284     1.3495	H	1	noname	0.0270
20	H9    -0.2657    -1.9895     0.4285	H	1	noname	0.0316
21	H10    -1.0357    -1.7190    -1.2739	H	1	noname	0.0316
22	H11     1.1221    -0.4202     1.3851	H	1	noname	0.0625
23	H12    -0.6299     0.1951    -2.4883	H	1	noname	0.0625
24	H13     2.6786     1.4677     0.9810	H	1	noname	0.0622
25	H14     0.9267     2.0831    -2.8924	H	1	noname	0.0622
26	H15     2.5809     2.7194    -1.1578	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	4	5	1
5	5	6	1
6	6	7	2
7	6	8	1
8	7	9	1
9	8	10	2
10	9	11	2
11	10	11	1
12	1	12	1
13	1	13	1
14	2	14	1
15	2	15	1
16	3	16	1
17	3	17	1
18	4	18	1
19	4	19	1
20	5	20	1
21	5	21	1
22	7	22	1
23	8	23	1
24	9	24	1
25	10	25	1
26	11	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1