@<TRIPOS>MOLECULE
DB03667
23 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.4878    -1.0814     0.5266	O.2	1	noname	-0.2800
2	C1    -0.9354    -1.4672    -0.5262	C.2	1	noname	0.0636
3	N1     0.0465    -2.3775    -0.4730	N.3	1	noname	0.0543
4	C2    -1.3396    -0.9519    -1.7523	C.2	1	noname	0.0141
5	O2     0.8177    -2.4414     0.5717	O.3	1	noname	-0.1765
6	C3    -0.7253    -1.3809    -2.9231	C.2	1	noname	0.0397
7	C4    -2.3582    -0.0077    -1.8076	C.2	1	noname	-0.0073
8	C5     2.0952    -2.8585     0.4432	C.2	1	noname	0.1647
9	O3     0.2639    -2.2980    -2.8694	O.3	1	noname	-0.2775
10	C6    -1.1296    -0.8657    -4.1491	C.2	1	noname	-0.0185
11	C7    -2.7624     0.5076    -3.0336	C.2	1	noname	-0.0588
12	O4     2.8366    -2.9199     1.4476	O.2	1	noname	-0.2448
13	C8     2.6107    -3.2378    -0.8691	C.3	1	noname	0.0236
14	C9    -2.1481     0.0786    -4.2044	C.2	1	noname	-0.0338
15	H1     0.2078    -3.0249    -1.2312	H	1	noname	0.1654
16	H2    -2.8399     0.3288    -0.8895	H	1	noname	0.0631
17	H3     0.4720    -2.4909    -1.9523	H	1	noname	0.2182
18	H4    -0.6479    -1.2021    -5.0672	H	1	noname	0.0650
19	H5    -3.5611     1.2481    -3.0769	H	1	noname	0.0622
20	H6     2.6414    -4.3246    -0.9471	H	1	noname	0.0336
21	H7     1.9595    -2.8361    -1.6453	H	1	noname	0.0336
22	H8     3.6162    -2.8361    -0.9944	H	1	noname	0.0336
23	H9    -2.4651     0.4826    -5.1658	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	4	6	2
6	4	7	1
7	5	8	1
8	6	9	1
9	6	10	1
10	7	11	2
11	8	12	2
12	8	13	1
13	10	14	2
14	11	14	1
15	3	15	1
16	7	16	1
17	9	17	1
18	10	18	1
19	11	19	1
20	13	20	1
21	13	21	1
22	13	22	1
23	14	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1