@<TRIPOS>MOLECULE
125340
38 41 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1     1.0446     0.6270    -1.3781	F	1	noname	-0.1470
2	C1    -0.1227     1.1443    -0.8787	C.3	1	noname	0.4955
3	F2    -0.2158     0.9963     0.4812	F	1	noname	-0.1470
4	O1    -0.1789     2.5559    -1.1548	O.3	1	noname	-0.2016
5	O2    -1.2453     0.4463    -1.4585	O.3	1	noname	-0.2063
6	C2    -1.4873     2.6934    -1.4178	C.2	1	noname	0.0400
7	C3    -2.1179     1.4576    -1.6514	C.2	1	noname	0.0174
8	C4    -2.2295     3.8912    -1.2899	C.2	1	noname	-0.0063
9	C5    -3.5053     1.3306    -1.9448	C.2	1	noname	-0.0110
10	C6    -3.6424     3.7190    -1.3122	C.2	1	noname	-0.0235
11	C7    -4.2745     2.5139    -1.7633	C.2	1	noname	-0.0490
12	N1    -4.4003     4.6822    -0.7345	N.3	1	noname	0.0084
13	C8    -4.6717     5.0796     0.5671	C.2	1	noname	0.0623
14	N2    -5.4193     6.2206     0.4725	N.2	1	noname	-0.2490
15	C9    -4.3768     4.5540     1.9039	C.2	1	noname	0.0095
16	C10    -5.9339     6.9280     1.5238	C.2	1	noname	0.0085
17	C11    -3.6348     3.3970     2.2961	C.2	1	noname	0.0827
18	C12    -4.9378     5.3169     2.9964	C.2	1	noname	-0.0056
19	C13    -5.7033     6.4807     2.8401	C.2	1	noname	-0.0425
20	N3    -3.5085     3.0775     3.6250	N.2	1	noname	-0.2174
21	N4    -3.0419     2.5786     1.3866	N.2	1	noname	-0.2388
22	C14    -2.8177     1.9801     4.0369	C.2	1	noname	0.0964
23	C15    -2.3422     1.4743     1.7837	C.2	1	noname	0.0686
24	N5    -2.2327     1.1771     3.1074	N.2	1	noname	-0.2276
25	N6    -2.7148     1.6937     5.3419	N.3	1	noname	-0.0771
26	C16    -1.7117     0.6128     0.7877	C.3	1	noname	0.0696
27	H1    -1.7525     4.8655    -1.1832	H	1	noname	0.0668
28	H2    -3.9473     0.3939    -2.2843	H	1	noname	0.0651
29	H3    -5.3448     2.4972    -1.9692	H	1	noname	0.0640
30	H4    -4.8730     5.2320    -1.4377	H	1	noname	0.1357
31	H5    -6.5143     7.8272     1.3174	H	1	noname	0.0839
32	H6    -4.7698     4.9876     4.0218	H	1	noname	0.0631
33	H7    -6.1013     7.0140     3.7034	H	1	noname	0.0639
34	H8    -1.8040     1.5857     5.7650	H	1	noname	0.1273
35	H9    -3.5480     1.5857     5.9025	H	1	noname	0.1273
36	H10    -1.1408    -0.1673     1.2913	H	1	noname	0.0312
37	H11    -2.4800     0.1557     0.1642	H	1	noname	0.0312
38	H12    -1.0436     1.2069     0.1642	H	1	noname	0.0312
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	2	4	1
4	2	5	1
5	4	6	1
6	5	7	1
7	6	8	1
8	6	7	2
9	7	9	1
10	8	10	2
11	9	11	2
12	10	12	1
13	10	11	1
14	12	13	1
15	13	14	2
16	13	15	1
17	14	16	1
18	15	17	1
19	15	18	2
20	16	19	2
21	17	20	2
22	17	21	1
23	18	19	1
24	20	22	1
25	21	23	2
26	22	24	2
27	22	25	1
28	23	26	1
29	23	24	1
30	8	27	1
31	9	28	1
32	11	29	1
33	12	30	1
34	16	31	1
35	18	32	1
36	19	33	1
37	25	34	1
38	25	35	1
39	26	36	1
40	26	37	1
41	26	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1