@<TRIPOS>MOLECULE
50333030
27 29 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     1.7664     1.1548    -0.1843	N.2	1	noname	-0.3014
2	N2     1.2911    -0.0493    -0.3162	N.3	1	noname	-0.0276
3	C1     0.8074     2.0530     0.1313	C.2	1	noname	0.0596
4	C2    -0.0231    -0.0156    -0.0706	C.2	1	noname	-0.0524
5	C3     0.9567     3.3179     0.3482	C.1	1	noname	0.0141
6	C4    -0.3681     1.3265     0.1720	C.2	1	noname	0.0198
7	C5    -0.9771    -1.0668    -0.0124	C.2	1	noname	-0.0338
8	C6     1.0948     4.4868     0.5486	C.1	1	noname	-0.0208
9	C7    -1.7100     1.7298     0.4091	C.2	1	noname	-0.0221
10	C8    -2.3333    -0.6764     0.2175	C.2	1	noname	-0.0490
11	C9     1.2442     5.7517     0.7655	C.2	1	noname	-0.0230
12	C10    -2.6924     0.6957     0.4170	C.2	1	noname	-0.0506
13	C11     0.1316     6.5551     0.9864	C.2	1	noname	-0.0389
14	C12     2.5175     6.3091     0.7779	C.2	1	noname	-0.0389
15	C13     0.2923     7.9159     1.2197	C.2	1	noname	-0.0558
16	C14     2.6782     7.6699     1.0112	C.2	1	noname	-0.0558
17	C15     1.5656     8.4733     1.2321	C.2	1	noname	-0.0646
18	H1     1.8405    -0.8599    -0.5634	H	1	noname	0.1755
19	H2    -0.6862    -2.1099    -0.1368	H	1	noname	0.0643
20	H3    -1.9714     2.7748     0.5756	H	1	noname	0.0630
21	H4    -3.1098    -1.4409     0.2411	H	1	noname	0.0623
22	H5    -3.7376     0.9592     0.5787	H	1	noname	0.0622
23	H6    -0.8669     6.1180     0.9767	H	1	noname	0.0635
24	H7     3.3899     5.6790     0.6047	H	1	noname	0.0635
25	H8    -0.5801     8.5459     1.3930	H	1	noname	0.0623
26	H9     3.6766     8.1070     1.0210	H	1	noname	0.0623
27	H10     1.6916     9.5404     1.4151	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	1	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	1
7	4	6	2
8	5	8	3
9	6	9	1
10	7	10	2
11	8	11	1
12	9	12	2
13	10	12	1
14	11	13	2
15	11	14	1
16	13	15	1
17	14	16	2
18	15	17	2
19	16	17	1
20	2	18	1
21	7	19	1
22	9	20	1
23	10	21	1
24	12	22	1
25	13	23	1
26	14	24	1
27	15	25	1
28	16	26	1
29	17	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1