@<TRIPOS>MOLECULE
69604735
28 30 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1    -3.8334    -2.7727     1.1048	F	1	noname	-0.1661
2	F2    -3.0409    -3.6116    -0.8137	F	1	noname	-0.1661
3	F3    -4.7325    -2.1454    -0.8472	F	1	noname	-0.1661
4	N1     0.8137     1.8030     1.9877	N.3	1	noname	-0.3154
5	C1     1.0042    -0.3633     0.6052	C.3	1	noname	0.0227
6	C2     0.3752     1.6782    -0.5480	C.3	1	noname	0.0217
7	C3     1.4357     0.5562    -0.5579	C.3	1	noname	-0.0370
8	C4    -0.4195    -0.4262     0.2191	C.2	1	noname	-0.0452
9	C5    -0.7896     0.7748    -0.4602	C.2	1	noname	-0.0524
10	C6     1.4212     0.4465     1.8884	C.3	1	noname	0.0021
11	C7     0.7739     2.5500     0.6996	C.3	1	noname	0.0021
12	C8    -1.3237    -1.5386     0.2955	C.2	1	noname	-0.0278
13	C9    -2.0747     0.9043    -1.0843	C.2	1	noname	-0.0522
14	C10    -2.6143    -1.3983    -0.2989	C.2	1	noname	-0.0164
15	C11    -2.9857    -0.1908    -0.9804	C.2	1	noname	-0.0332
16	C12    -3.5698    -2.4988    -0.2124	C.3	1	noname	0.4161
17	H1     1.5159    -1.3246     0.5569	H	1	noname	0.0365
18	H2     0.4107     2.2596    -1.4687	H	1	noname	0.0365
19	H3     1.3746     0.0068    -1.4973	H	1	noname	0.0280
20	H4     2.4543     0.9296    -0.4525	H	1	noname	0.0280
21	H5     1.1709    -0.1298     2.7790	H	1	noname	0.0434
22	H6     2.5063     0.5409     1.8463	H	1	noname	0.0434
23	H7     0.0874     3.3919     0.7889	H	1	noname	0.0434
24	H8     1.7652     2.9492     0.4846	H	1	noname	0.0434
25	H9     1.3199     2.3527     2.6848	H	1	noname	0.1222
26	H10    -1.0520    -2.4045     0.7612	H	1	noname	0.0631
27	H11    -2.3304     1.7538    -1.5877	H	1	noname	0.0625
28	H12    -3.9138    -0.1136    -1.3965	H	1	noname	0.0628
@<TRIPOS>BOND
1	1	16	1
2	2	16	1
3	3	16	1
4	4	10	1
5	4	11	1
6	4	25	1
7	5	7	1
8	5	8	1
9	5	10	1
10	5	17	1
11	6	7	1
12	6	9	1
13	6	11	1
14	6	18	1
15	7	19	1
16	7	20	1
17	8	9	2
18	8	12	1
19	9	13	1
20	10	21	1
21	10	22	1
22	11	23	1
23	11	24	1
24	12	14	2
25	12	26	1
26	13	15	2
27	13	27	1
28	14	15	1
29	14	16	1
30	15	28	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1