@<TRIPOS>MOLECULE
86278119
28 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -4.1486    -1.5080     1.2145	N.2	1	noname	-0.2644
2	N2    -6.1829    -1.8663     2.0777	N.3	1	noname	-0.1342
3	N3    -4.9639    -3.5927     1.2520	N.3	1	noname	-0.1342
4	C1    -0.7644    -1.3382    -0.2893	C.3	1	noname	0.0064
5	C2    -2.0410    -0.8142     0.3714	C.3	1	noname	-0.0293
6	C3     0.1520    -0.2267    -0.5272	C.2	1	noname	-0.0578
7	C4    -3.0013    -1.9789     0.6207	C.3	1	noname	0.0421
8	C5     1.0792     0.1299     0.4451	C.2	1	noname	-0.0651
9	C6     0.0972     0.4748    -1.7259	C.2	1	noname	-0.0651
10	C7     1.9516     1.1880     0.2186	C.2	1	noname	-0.0635
11	C8     0.9696     1.5329    -1.9524	C.2	1	noname	-0.0635
12	C9     1.8968     1.8896    -0.9802	C.2	1	noname	-0.0695
13	C10    -5.0898    -2.3149     1.5120	C.2	1	noname	-0.1445
14	H1    -1.0147    -1.8122    -1.2383	H	1	noname	0.0316
15	H2    -0.2887    -2.0672     0.3667	H	1	noname	0.0316
16	H3    -2.5167    -0.0851    -0.2846	H	1	noname	0.0289
17	H4    -1.7907    -0.3401     1.3205	H	1	noname	0.0289
18	H5    -3.2516    -2.4530    -0.3284	H	1	noname	0.0515
19	H6    -2.5256    -2.7080     1.2767	H	1	noname	0.0515
20	H7     1.1193    -0.3849     1.3247	H	1	noname	0.0625
21	H8    -0.5832     0.2131    -2.4394	H	1	noname	0.0625
22	H9     2.6319     1.4498     0.9320	H	1	noname	0.0622
23	H10     0.9294     2.0477    -2.8321	H	1	noname	0.0622
24	H11     2.5370     2.6661    -1.1464	H	1	noname	0.0622
25	H12    -6.7917    -2.6047     2.2357	H	1	noname	0.1267
26	H13    -6.6062    -1.2175     1.4939	H	1	noname	0.1267
27	H14    -5.7631    -4.0614     1.5391	H	1	noname	0.1267
28	H15    -4.8406    -3.7179     0.2981	H	1	noname	0.1267
@<TRIPOS>BOND
1	1	7	1
2	1	13	2
3	2	13	1
4	2	25	1
5	2	26	1
6	3	13	1
7	3	27	1
8	3	28	1
9	4	5	1
10	4	6	1
11	4	14	1
12	4	15	1
13	5	7	1
14	5	16	1
15	5	17	1
16	6	8	2
17	6	9	1
18	7	18	1
19	7	19	1
20	8	10	1
21	8	20	1
22	9	11	2
23	9	21	1
24	10	12	2
25	10	22	1
26	11	12	1
27	11	23	1
28	12	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1