@<TRIPOS>MOLECULE
DB04026
25 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.3113     1.3229    -2.8561	O.3	1	noname	-0.3929
2	C1     1.6471     0.4902    -1.9170	C.3	1	noname	0.0571
3	C2     0.3823     1.2330    -1.3625	C.3	1	noname	-0.0112
4	C3     2.6865    -0.0494    -0.8681	C.3	1	noname	-0.0112
5	C4     0.0367     0.8925     0.1326	C.3	1	noname	0.0121
6	C5     2.1059    -0.1709     0.5921	C.3	1	noname	0.0121
7	N1     1.2714     1.0102     0.9537	N.3	1	noname	-0.3002
8	C6    -0.2869    -0.6049     0.2834	C.3	1	noname	-0.0359
9	C7     1.0303    -1.2601     0.7410	C.3	1	noname	-0.0359
10	C8     0.9218     0.9442     2.3717	C.3	1	noname	-0.0127
11	H1     2.8342     1.9785    -2.3889	H	1	noname	0.2104
12	H2     1.2812    -0.3741    -2.4712	H	1	noname	0.0601
13	H3     0.6342     2.2934    -1.3745	H	1	noname	0.0309
14	H4    -0.4576     0.8656    -1.9521	H	1	noname	0.0309
15	H5     2.9243    -1.0661    -1.1810	H	1	noname	0.0309
16	H6     3.4736     0.7028    -0.8153	H	1	noname	0.0309
17	H7    -0.7632     1.5538     0.4657	H	1	noname	0.0468
18	H8     2.9854    -0.3121     1.2203	H	1	noname	0.0468
19	H9    -1.0071    -0.7073     1.0952	H	1	noname	0.0283
20	H10    -0.5233    -0.9934    -0.7071	H	1	noname	0.0283
21	H11     1.2667    -2.0552     0.0338	H	1	noname	0.0283
22	H12     0.9353    -1.4860     1.8031	H	1	noname	0.0283
23	H13     0.8460    -0.0989     2.6791	H	1	noname	0.0394
24	H14     1.6935     1.4410     2.9597	H	1	noname	0.0394
25	H15    -0.0348     1.4410     2.5337	H	1	noname	0.0394
@<TRIPOS>BOND
1	2	1	1
2	2	3	1
3	2	4	1
4	3	5	1
5	4	6	1
6	5	7	1
7	5	8	1
8	6	9	1
9	6	7	1
10	7	10	1
11	8	9	1
12	1	11	1
13	2	12	1
14	3	13	1
15	3	14	1
16	4	15	1
17	4	16	1
18	5	17	1
19	6	18	1
20	8	19	1
21	8	20	1
22	9	21	1
23	9	22	1
24	10	23	1
25	10	24	1
26	10	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1