@<TRIPOS>MOLECULE
76966647
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     1.2480    -2.7552    -1.3085	Cl	1	noname	-0.0611
2	O1     1.4187     4.7417    -0.7199	O.3	1	noname	-0.2191
3	O2     3.1443     3.8369     0.4097	O.2	1	noname	-0.2597
4	N1    -1.4330    -3.1087    -1.1780	N.3	1	noname	0.0087
5	N2    -2.1087    -1.3449    -0.0982	N.2	1	noname	-0.1796
6	N3    -4.8048    -3.2986    -0.8059	N.1	1	noname	-0.1633
7	C1    -0.0098    -0.0238     0.0370	C.2	1	noname	-0.0031
8	C2    -0.7733    -1.2020    -0.2483	C.2	1	noname	0.0669
9	C3     1.4385     0.0283     0.0810	C.2	1	noname	-0.0102
10	C4    -0.7529     1.2241     0.0825	C.2	1	noname	-0.0102
11	C5    -0.3449    -2.3645    -0.9134	C.2	1	noname	-0.0209
12	C6     1.3465     2.4826     0.0027	C.2	1	noname	0.0098
13	C7     2.1272     1.2837     0.0503	C.2	1	noname	0.0038
14	C8    -0.0848     2.4800     0.0464	C.2	1	noname	0.0038
15	C9    -2.5065    -2.4889    -0.6800	C.2	1	noname	0.0166
16	C10     2.0065     3.7023    -0.0901	C.2	1	noname	0.0854
17	C11    -3.7235    -2.9176    -0.7467	C.1	1	noname	0.1026
18	H1     1.9729    -0.8389     0.1345	H	1	noname	0.0629
19	H2    -1.7709     1.1994     0.1414	H	1	noname	0.0629
20	H3     3.1464     1.3225     0.0620	H	1	noname	0.0631
21	H4    -0.6107     3.3539     0.0516	H	1	noname	0.0631
22	H5    -1.4377    -3.9552    -1.6518	H	1	noname	0.1559
23	H6     1.6176     5.6598    -0.4408	H	1	noname	0.2216
@<TRIPOS>BOND
1	1	11	1
2	2	16	1
3	2	23	1
4	3	16	2
5	4	11	1
6	4	15	1
7	4	22	1
8	5	8	1
9	5	15	2
10	6	17	3
11	7	8	1
12	7	9	2
13	7	10	1
14	8	11	2
15	9	13	1
16	9	18	1
17	10	14	2
18	10	19	1
19	12	13	2
20	12	14	1
21	12	16	1
22	13	20	1
23	14	21	1
24	15	17	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1