@<TRIPOS>MOLECULE

25 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	C1    -2.5731    -1.0347    -4.6891	C.3	1	noname	0.0073
2	N1    -1.8595    -1.4926    -3.5416	N.3	1	noname	0.0767
3	C2    -1.8537    -0.9744    -2.2865	C.2	1	noname	0.0488
4	O1    -2.5511     0.0283    -1.9963	O.2	1	noname	-0.2751
5	N2    -1.0428    -1.5942    -1.3686	N.3	1	noname	0.1051
6	C3    -0.3679    -2.6614    -1.8684	C.2	1	noname	0.1024
7	O2     0.4520    -3.4058    -1.2831	O.2	1	noname	-0.2636
8	S1    -0.8090    -2.8306    -3.5499	S.3	1	noname	-0.0415
9	C4    -0.9028    -1.1365    -0.0069	C.3	1	noname	0.0409
10	C5    -0.0674     0.0925     0.0521	C.2	1	noname	-0.0483
11	C6    -0.6372     1.3572     0.3326	C.2	1	noname	-0.0529
12	C7     0.1685     2.5098     0.3888	C.2	1	noname	-0.0594
13	C8     1.5543     2.4095     0.1690	C.2	1	noname	-0.0613
14	C9     2.1306     1.1627    -0.1312	C.2	1	noname	-0.0594
15	C10     1.3246     0.0114    -0.1887	C.2	1	noname	-0.0529
16	H1    -2.9290    -1.8914    -5.2613	H	1	noname	0.0410
17	H2    -3.4235    -0.4314    -4.3712	H	1	noname	0.0410
18	H3    -1.9120    -0.4314    -5.3113	H	1	noname	0.0410
19	H4    -1.9045    -0.8579     0.3204	H	1	noname	0.0492
20	H5    -0.3561    -1.9198     0.5181	H	1	noname	0.0492
21	H6    -1.7096     1.4447     0.5074	H	1	noname	0.0626
22	H7    -0.2806     3.4797     0.6026	H	1	noname	0.0622
23	H8     2.1820     3.2984     0.2312	H	1	noname	0.0622
24	H9     3.2017     1.0886    -0.3191	H	1	noname	0.0622
25	H10     1.7818    -0.9502    -0.4216	H	1	noname	0.0626
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	2
4	3	5	1
5	5	6	1
6	6	7	2
7	6	8	1
8	2	8	1
9	5	9	1
10	9	10	1
11	10	11	2
12	11	12	1
13	12	13	2
14	13	14	1
15	14	15	2
16	10	15	1
17	1	16	1
18	1	17	1
19	1	18	1
20	9	19	1
21	9	20	1
22	11	21	1
23	12	22	1
24	13	23	1
25	14	24	1
26	15	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1