@<TRIPOS>MOLECULE
71316322
27 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1    -0.7203    -3.2204     0.7468	S.2	1	noname	0.1725
2	F1    -0.6124    -0.3902    -6.1088	F	1	noname	-0.1510
3	O1    -2.2068    -2.3141    -1.0844	O.3	1	noname	-0.3483
4	O2    -1.1538    -4.6184     1.3680	O.2	1	noname	-0.3012
5	O3    -4.6217    -2.1824     0.5959	O.3	1	noname	-0.3931
6	O4    -1.2010    -4.8333    -3.0931	O.2	1	noname	-0.2481
7	N1    -0.9323    -2.5610    -3.1535	N.3	1	noname	0.0701
8	N2    -0.9066    -3.8802    -5.1425	N.2	1	noname	-0.1407
9	N3    -0.6205    -2.9252    -7.2625	N.3	1	noname	-0.1141
10	C1    -0.8801    -2.4163    -1.6927	C.3	1	noname	0.1305
11	C2    -0.0372    -3.4850    -0.9450	C.3	1	noname	0.0498
12	C3    -2.2245    -2.2281     0.3573	C.3	1	noname	0.1410
13	C4    -3.4632    -2.9468     0.8959	C.3	1	noname	0.0767
14	C5    -0.8218    -1.4345    -3.9698	C.2	1	noname	0.0079
15	C6    -1.0203    -3.7999    -3.7727	C.2	1	noname	0.1077
16	C7    -0.7211    -1.4649    -5.3835	C.2	1	noname	0.0433
17	C8    -0.7495    -2.7708    -5.9377	C.2	1	noname	0.0091
18	H1    -0.3687    -1.4856    -1.4315	H	1	noname	0.0792
19	H2    -0.3145    -4.4784    -1.2975	H	1	noname	0.0389
20	H3     1.0462    -3.3887    -1.0161	H	1	noname	0.0389
21	H4    -2.0887    -1.1853     0.6440	H	1	noname	0.0711
22	H5    -3.5449    -3.9287     0.4298	H	1	noname	0.0595
23	H6    -3.3746    -3.0635     1.9760	H	1	noname	0.0595
24	H7    -0.8128    -0.5213    -3.5154	H	1	noname	0.0790
25	H8    -5.4151    -2.6428     0.9409	H	1	noname	0.2101
26	H9    -0.6599    -3.8689    -7.4835	H	1	noname	0.1258
27	H10    -1.3401    -2.4571    -7.7142	H	1	noname	0.1258
@<TRIPOS>BOND
1	1	4	2
2	1	11	1
3	1	12	1
4	2	16	1
5	3	10	1
6	3	12	1
7	5	13	1
8	5	25	1
9	6	15	2
10	10	7	1
11	7	14	1
12	7	15	1
13	8	15	1
14	8	17	2
15	9	17	1
16	9	26	1
17	9	27	1
18	10	11	1
19	10	18	1
20	11	19	1
21	11	20	1
22	12	13	1
23	12	21	1
24	13	22	1
25	13	23	1
26	14	16	2
27	14	24	1
28	16	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1