@<TRIPOS>MOLECULE
DB01929
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.2941    -1.5126     0.0000	Cl	1	noname	0.1024
2	O1     2.6837    -2.1809     1.3397	O.2	1	noname	-0.1760
3	O2     2.6837    -2.1809    -1.3397	O.2	1	noname	-0.1760
4	C1     1.4444    -0.0553     0.0000	C.2	1	noname	0.0386
5	C2     0.0291    -0.0257    -0.0000	C.2	1	noname	-0.0335
6	C3     2.1189     1.1967    -0.0000	C.2	1	noname	0.0402
7	C4    -0.6918    -1.2356    -0.0000	C.2	1	noname	0.0371
8	C5    -0.7108     1.2145    -0.0000	C.2	1	noname	0.0460
9	N1     3.4588     1.2161    -0.0000	N.3	1	noname	-0.1388
10	C6     1.4011     2.4415    -0.0000	C.2	1	noname	-0.0087
11	N2    -2.0514    -1.1797     0.0000	N.2	1	noname	-0.2470
12	N3    -0.0539    -2.4141    -0.0000	N.3	1	noname	-0.1127
13	N4    -2.0764     1.1897     0.0000	N.2	1	noname	-0.2552
14	C7    -0.0293     2.4705    -0.0000	C.2	1	noname	0.0154
15	C8    -2.7416     0.0023     0.0000	C.2	1	noname	0.0668
16	N5    -4.0815    -0.0096     0.0000	N.3	1	noname	-0.0820
17	H1     3.9764     0.3489    -0.0000	H	1	noname	0.1243
18	H2     3.9511     2.0980    -0.0000	H	1	noname	0.1243
19	H3     1.9522     3.3819     0.0000	H	1	noname	0.0640
20	H4    -0.5827    -3.2746    -0.0000	H	1	noname	0.1258
21	H5     0.9557    -2.4418    -0.0000	H	1	noname	0.1258
22	H6    -0.5781     3.4123    -0.0000	H	1	noname	0.0646
23	H7    -4.5943     0.8606     0.0000	H	1	noname	0.1273
24	H8    -4.5787    -0.8887     0.0000	H	1	noname	0.1273
@<TRIPOS>BOND
1	1	2	2
2	1	3	2
3	1	4	1
4	4	5	1
5	4	6	2
6	5	7	2
7	5	8	1
8	6	9	1
9	6	10	1
10	7	11	1
11	7	12	1
12	8	13	2
13	8	14	1
14	10	14	2
15	11	15	2
16	13	15	1
17	15	16	1
18	9	17	1
19	9	18	1
20	10	19	1
21	12	20	1
22	12	21	1
23	14	22	1
24	16	23	1
25	16	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1