@<TRIPOS>MOLECULE
DB01855
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.6713    -1.3630    -2.3403	O.2	1	noname	-0.2495
2	C1    -0.4956    -1.5862    -1.9793	C.2	1	noname	0.1439
3	O2     0.0958    -2.7584    -2.2932	O.3	1	noname	-0.2139
4	C2     0.2716    -0.5329    -1.1834	C.3	1	noname	0.0977
5	N1     1.4725    -0.1127    -1.8905	N.3	1	noname	-0.2879
6	C3     0.8059    -1.0555     0.1497	C.3	1	noname	-0.0163
7	C4     2.1387     0.6955    -0.8478	C.3	1	noname	0.0848
8	C5     1.8541     0.0044     0.4826	C.3	1	noname	-0.0174
9	C6    -0.3092    -1.0165     1.1966	C.3	1	noname	-0.0604
10	N2     3.5804     0.7110    -1.0903	N.3	1	noname	-0.1367
11	O3     3.8273     1.2506    -2.3051	O.3	1	noname	-0.3540
12	C7     4.2395     1.5105    -0.0589	C.3	1	noname	0.0142
13	H1     0.3308    -3.2241    -1.4873	H	1	noname	0.2213
14	H2    -0.4238     0.2975    -1.0612	H	1	noname	0.0577
15	H3     1.7611    -0.3221    -2.8354	H	1	noname	0.1246
16	H4     1.1847    -2.0772     0.1202	H	1	noname	0.0322
17	H5     1.7966     1.7299    -0.8794	H	1	noname	0.0660
18	H6     1.3905     0.7354     1.1451	H	1	noname	0.0300
19	H7     2.7635    -0.5113     0.7912	H	1	noname	0.0300
20	H8     0.1288    -1.0318     2.1946	H	1	noname	0.0234
21	H9    -0.8942    -0.1056     1.0704	H	1	noname	0.0234
22	H10    -0.9564    -1.8844     1.0704	H	1	noname	0.0234
23	H11     3.9577     0.5485    -2.9467	H	1	noname	0.2377
24	H12     3.9421     1.1497     0.9258	H	1	noname	0.0419
25	H13     5.3206     1.4227    -0.1667	H	1	noname	0.0419
26	H14     3.9472     2.5550    -0.1667	H	1	noname	0.0419
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	4	2	1
4	4	5	1
5	4	6	1
6	5	7	1
7	6	8	1
8	6	9	1
9	7	10	1
10	7	8	1
11	10	11	1
12	10	12	1
13	3	13	1
14	4	14	1
15	5	15	1
16	6	16	1
17	7	17	1
18	8	18	1
19	8	19	1
20	9	20	1
21	9	21	1
22	9	22	1
23	11	23	1
24	12	24	1
25	12	25	1
26	12	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1