@<TRIPOS>MOLECULE
119025800
40 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -0.2244    -2.8041    -0.2984	N.1	1	noname	-0.1935
2	N2    -2.7025     0.1503    -1.2944	N.1	1	noname	-0.1935
3	C1     0.2913    -0.3809     0.1042	C.3	1	noname	0.0731
4	C2    -0.2206     0.4519    -1.0728	C.3	1	noname	0.0731
5	C3     1.8042    -0.1970     0.2393	C.3	1	noname	-0.0308
6	C4     0.4661    -0.0086    -2.3602	C.3	1	noname	-0.0308
7	C5     2.3160    -1.0298     1.4163	C.3	1	noname	-0.0455
8	C6     0.1518    -1.4857    -2.6056	C.3	1	noname	-0.0455
9	C7    -0.3954     0.0796     1.3916	C.3	1	noname	-0.0449
10	C8     0.0938     1.9290    -0.8274	C.3	1	noname	-0.0449
11	C9     0.0115    -1.6958    -0.1143	C.1	1	noname	0.0663
12	C10    -1.5673     0.2882    -1.1931	C.1	1	noname	0.0663
13	C11     3.8289    -0.8459     1.5514	C.3	1	noname	-0.0627
14	C12     2.0017    -2.5069     1.1709	C.3	1	noname	-0.0627
15	C13     0.8384    -1.9462    -3.8930	C.3	1	noname	-0.0627
16	C14    -1.3611    -1.6695    -2.7407	C.3	1	noname	-0.0627
17	H1     2.0281     0.8553     0.4141	H	1	noname	0.0286
18	H2     2.2934    -0.5251    -0.6778	H	1	noname	0.0286
19	H3     0.1014     0.5847    -3.1987	H	1	noname	0.0286
20	H4     1.5439     0.1224    -2.2639	H	1	noname	0.0286
21	H5     1.8268    -0.7017     2.3335	H	1	noname	0.0297
22	H6     0.5164    -2.0790    -1.7671	H	1	noname	0.0297
23	H7    -0.0307    -0.5136     2.2301	H	1	noname	0.0247
24	H8    -1.4732    -0.0513     1.2953	H	1	noname	0.0247
25	H9    -0.1714     1.1319     1.5664	H	1	noname	0.0247
26	H10    -0.2709     2.5223    -1.6659	H	1	noname	0.0247
27	H11    -0.3954     2.2571     0.0898	H	1	noname	0.0247
28	H12     1.1716     2.0600    -0.7311	H	1	noname	0.0247
29	H13     2.3664    -3.1002     2.0094	H	1	noname	0.0233
30	H14     0.9239    -2.6379     1.0746	H	1	noname	0.0233
31	H15     2.4909    -2.8349     0.2537	H	1	noname	0.0233
32	H16     4.1936    -1.4392     2.3900	H	1	noname	0.0233
33	H17     4.0529     0.2064     1.7263	H	1	noname	0.0233
34	H18     4.3181    -1.1740     0.6343	H	1	noname	0.0233
35	H19     0.6145    -2.9985    -4.0678	H	1	noname	0.0233
36	H20     0.4738    -1.3529    -4.7315	H	1	noname	0.0233
37	H21     1.9163    -1.8152    -3.7968	H	1	noname	0.0233
38	H22    -1.5851    -2.7219    -2.9156	H	1	noname	0.0233
39	H23    -1.8503    -1.3415    -1.8236	H	1	noname	0.0233
40	H24    -1.7258    -1.0763    -3.5793	H	1	noname	0.0233
@<TRIPOS>BOND
1	1	11	3
2	2	12	3
3	3	4	1
4	3	5	1
5	3	9	1
6	3	11	1
7	4	6	1
8	4	10	1
9	4	12	1
10	5	7	1
11	5	17	1
12	5	18	1
13	6	8	1
14	6	19	1
15	6	20	1
16	7	13	1
17	7	14	1
18	7	21	1
19	8	15	1
20	8	16	1
21	8	22	1
22	9	23	1
23	9	24	1
24	9	25	1
25	10	26	1
26	10	27	1
27	10	28	1
28	13	32	1
29	13	33	1
30	13	34	1
31	14	29	1
32	14	30	1
33	14	31	1
34	15	35	1
35	15	36	1
36	15	37	1
37	16	38	1
38	16	39	1
39	16	40	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1