@<TRIPOS>MOLECULE
73443026
38 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     1.1303     2.4849     0.2660	S.3	1	noname	-0.1558
2	F1     9.4369    -1.8464    -0.9078	F	1	noname	-0.1630
3	O1     3.1659    -1.5136    -0.4233	O.2	1	noname	-0.2748
4	N1     3.3439     0.7318    -0.2149	N.3	1	noname	-0.0874
5	N2     1.0121     0.0450    -0.1210	N.2	1	noname	-0.1798
6	N3    -1.1768    -1.5985    -0.7836	N.2	1	noname	-0.2359
7	N4    -4.7272    -0.8697     1.1495	N.3	1	noname	-0.1076
8	N5    -3.3463    -2.3033    -0.2173	N.2	1	noname	-0.2291
9	C1     1.9844     0.9692    -0.0504	C.2	1	noname	0.1119
10	C2    -0.2792     0.4506     0.0317	C.2	1	noname	0.0663
11	C3     3.9563    -0.5349    -0.3484	C.2	1	noname	0.0940
12	C4     5.3690    -0.9033    -0.4497	C.2	1	noname	-0.0129
13	C5    -1.3115    -0.4855    -0.0140	C.2	1	noname	0.0417
14	C6     4.0432     1.9651    -0.2210	C.3	1	noname	0.0019
15	C7    -0.4727     1.8247     0.2303	C.2	1	noname	0.0673
16	C8    -2.4947    -0.2763     0.7055	C.2	1	noname	0.0191
17	C9     5.8226    -2.2299    -0.7254	C.2	1	noname	0.0063
18	C10     6.4303     0.0405    -0.2704	C.2	1	noname	0.0063
19	C11    -3.5485    -1.1916     0.5541	C.2	1	noname	0.0484
20	C12     7.1796    -2.5785    -0.8678	C.2	1	noname	0.0075
21	C13     7.7737    -0.2675    -0.5180	C.2	1	noname	0.0075
22	C14     8.1619    -1.5825    -0.7840	C.2	1	noname	0.0437
23	C15    -2.1762    -2.5053    -0.8761	C.2	1	noname	0.0584
24	C16    -5.9861    -0.8951     0.4955	C.3	1	noname	-0.0101
25	H1     4.4964     2.1576    -1.1908	H	1	noname	0.0404
26	H2     3.3554     2.7740     0.0256	H	1	noname	0.0404
27	H3     4.8765     1.9023     0.4788	H	1	noname	0.0404
28	H4    -1.3538     2.3577     0.3369	H	1	noname	0.0764
29	H5    -2.6081     0.5418     1.3117	H	1	noname	0.0679
30	H6     5.1448    -2.9981    -0.8266	H	1	noname	0.0631
31	H7     6.2742     0.9908     0.0605	H	1	noname	0.0631
32	H8     7.4468    -3.5441    -1.0259	H	1	noname	0.0653
33	H9     8.4753     0.4721    -0.4758	H	1	noname	0.0653
34	H10    -4.6289    -0.0324     1.6293	H	1	noname	0.1292
35	H11    -2.0502    -3.3251    -1.4719	H	1	noname	0.1062
36	H12    -6.7655    -0.5944     1.1957	H	1	noname	0.0396
37	H13    -6.1891    -1.9044     0.1373	H	1	noname	0.0396
38	H14    -5.9708    -0.2061    -0.3490	H	1	noname	0.0396
@<TRIPOS>BOND
1	1	9	1
2	1	15	1
3	2	22	1
4	3	11	2
5	4	9	1
6	4	11	1
7	4	14	1
8	5	9	2
9	5	10	1
10	6	13	1
11	6	23	2
12	7	19	1
13	7	24	1
14	7	34	1
15	8	19	2
16	8	23	1
17	10	13	1
18	10	15	2
19	11	12	1
20	12	17	2
21	12	18	1
22	13	16	2
23	14	25	1
24	14	26	1
25	14	27	1
26	15	28	1
27	16	19	1
28	16	29	1
29	17	20	1
30	17	30	1
31	18	21	2
32	18	31	1
33	20	22	2
34	20	32	1
35	21	22	1
36	21	33	1
37	23	35	1
38	24	36	1
39	24	37	1
40	24	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1