@<TRIPOS>MOLECULE
DB02655
16 15 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.9440    -2.4245     0.3520	O.2	1	noname	-0.2495
2	C1     1.8646    -1.1863     0.5045	C.2	1	noname	0.1440
3	O2     2.3967    -0.6058     1.6011	O.3	1	noname	-0.2139
4	C2     1.1965    -0.3680    -0.5032	C.3	1	noname	0.1006
5	N1     2.1416     0.6077    -1.0436	N.3	1	noname	-0.3190
6	C3     0.0159     0.3656     0.1364	C.3	1	noname	0.0582
7	C4    -0.6522     1.1839    -0.8714	C.2	1	noname	0.1358
8	O3    -1.6491     1.8702    -0.5586	O.2	1	noname	-0.2553
9	O4    -0.1935     1.1993    -2.1409	O.3	1	noname	-0.2184
10	H1     2.6928    -1.2854     2.2111	H	1	noname	0.2213
11	H2     0.8789    -1.0218    -1.3155	H	1	noname	0.0577
12	H3     3.0964     0.3362    -1.2302	H	1	noname	0.1192
13	H4     1.8398     1.5533    -1.2302	H	1	noname	0.1192
14	H5    -0.7117    -0.3859     0.4428	H	1	noname	0.0394
15	H6     0.4202     1.0636     0.8695	H	1	noname	0.0394
16	H7    -0.0812     0.2980    -2.4516	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	6	7	1
7	7	8	2
8	7	9	1
9	3	10	1
10	4	11	1
11	5	12	1
12	5	13	1
13	6	14	1
14	6	15	1
15	9	16	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
