@<TRIPOS>MOLECULE
125403
38 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1     5.6176    -4.7950     0.1002	F	1	noname	-0.1465
2	C1     4.4089    -4.3215     0.0141	C.2	1	noname	0.0783
3	C2     3.2852    -5.1455    -0.2970	C.2	1	noname	0.0787
4	C3     4.1106    -2.9357     0.2247	C.2	1	noname	0.0228
5	O1     3.4742    -6.4649    -0.5111	O.3	1	noname	-0.2346
6	N1     2.0123    -4.6252    -0.3837	N.2	1	noname	-0.2146
7	C4     2.7827    -2.3893     0.1348	C.2	1	noname	0.0044
8	C5     3.3542    -7.1658     0.7180	C.3	1	noname	0.0441
9	C6     1.7491    -3.2973    -0.1787	C.2	1	noname	0.0025
10	N2     2.5587    -1.0543     0.3468	N.3	1	noname	0.0153
11	C7     1.6219    -0.0297     0.4002	C.2	1	noname	0.0624
12	N3     2.3978     1.0565     0.7095	N.2	1	noname	-0.2485
13	C8     0.1875     0.1875     0.2350	C.2	1	noname	0.0100
14	C9     1.9370     2.3307     0.8765	C.2	1	noname	0.0086
15	C10    -0.8859    -0.7028    -0.0810	C.2	1	noname	0.0827
16	C11    -0.2650     1.5371     0.4169	C.2	1	noname	-0.0056
17	C12     0.5674     2.6170     0.7331	C.2	1	noname	-0.0421
18	N4    -2.1841    -0.2457    -0.1829	N.2	1	noname	-0.2174
19	N5    -0.6789    -2.0245    -0.2929	N.2	1	noname	-0.2388
20	C13    -3.2181    -1.0664    -0.4806	C.2	1	noname	0.0964
21	C14    -1.6906    -2.8822    -0.5942	C.2	1	noname	0.0686
22	N6    -2.9507    -2.3839    -0.6831	N.2	1	noname	-0.2276
23	N7    -4.4688    -0.5943    -0.5729	N.3	1	noname	-0.0771
24	C15    -1.4288    -4.3012    -0.8160	C.3	1	noname	0.0696
25	H1     4.9346    -2.2639     0.4651	H	1	noname	0.0672
26	H2     3.3727    -8.2389     0.5277	H	1	noname	0.0535
27	H3     4.1846    -6.8983     1.3714	H	1	noname	0.0535
28	H4     2.4130    -6.8983     1.1985	H	1	noname	0.0535
29	H5     0.7153    -2.9626    -0.2652	H	1	noname	0.0857
30	H6     3.4661    -0.6592     0.5486	H	1	noname	0.1358
31	H7     2.6561     3.1122     1.1220	H	1	noname	0.0839
32	H8    -1.3262     1.7598     0.3060	H	1	noname	0.0631
33	H9     0.1712     3.6244     0.8606	H	1	noname	0.0639
34	H10    -4.6312     0.4020    -0.6078	H	1	noname	0.1273
35	H11    -5.2490    -1.2347    -0.6078	H	1	noname	0.1273
36	H12    -1.3353    -4.8080     0.1445	H	1	noname	0.0312
37	H13    -2.2530    -4.7391    -1.3791	H	1	noname	0.0312
38	H14    -0.5026    -4.4161    -1.3791	H	1	noname	0.0312
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	5	8	1
8	6	9	2
9	7	10	1
10	7	9	1
11	10	11	1
12	11	12	2
13	11	13	1
14	12	14	1
15	13	15	1
16	13	16	2
17	14	17	2
18	15	18	2
19	15	19	1
20	16	17	1
21	18	20	1
22	19	21	2
23	20	22	2
24	20	23	1
25	21	24	1
26	21	22	1
27	4	25	1
28	8	26	1
29	8	27	1
30	8	28	1
31	9	29	1
32	10	30	1
33	14	31	1
34	16	32	1
35	17	33	1
36	23	34	1
37	23	35	1
38	24	36	1
39	24	37	1
40	24	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1