@<TRIPOS>MOLECULE
DB03140
19 19 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.8807    -2.0840    -2.4174	O.2	1	noname	-0.2594
2	C1     0.9383    -1.6421    -1.2495	C.2	1	noname	0.0880
3	O2     0.6952    -2.4620    -0.2048	O.3	1	noname	-0.2189
4	C2     1.2526    -0.3066    -1.0264	C.2	1	noname	0.0174
5	C3     1.3166     0.1848     0.2722	C.2	1	noname	0.0053
6	C4     1.5028     0.5375    -2.1020	C.2	1	noname	0.0053
7	C5     1.6309     1.5203     0.4953	C.2	1	noname	-0.0083
8	C6     1.8171     1.8730    -1.8790	C.2	1	noname	-0.0083
9	C7     1.8811     2.3644    -0.5803	C.2	1	noname	-0.0092
10	B1     2.2361     3.8728    -0.3283	B	1	noname	0.1182
11	O3     1.0826     4.5512     0.4133	O.3	1	noname	-0.2909
12	O4     3.5087     3.9631     0.5162	O.3	1	noname	-0.2909
13	H1     0.7622    -3.3754    -0.4926	H	1	noname	0.2216
14	H2     1.1204    -0.4772     1.1157	H	1	noname	0.0630
15	H3     1.4526     0.1522    -3.1204	H	1	noname	0.0630
16	H4     1.6811     1.9056     1.5137	H	1	noname	0.0619
17	H5     2.0133     2.5349    -2.7224	H	1	noname	0.0619
18	H6     1.2195     4.4707     1.3601	H	1	noname	0.1901
19	H7     3.2765     3.9466     1.4476	H	1	noname	0.1901
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	2
5	4	6	1
6	5	7	1
7	6	8	2
8	7	9	2
9	8	9	1
10	9	10	1
11	10	11	1
12	10	12	1
13	3	13	1
14	5	14	1
15	6	15	1
16	7	16	1
17	8	17	1
18	11	18	1
19	12	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1