@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442787
36 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     0.2618   -14.3838     7.6124	Cl	1	noname	-0.0895
2	C1     1.1087   -14.7337     6.1905	C.2	1	noname	-0.0276
3	C2     2.5166   -14.7577     6.1945	C.2	1	noname	-0.0248
4	C3     0.4087   -15.0017     4.9985	C.2	1	noname	-0.0248
5	C4     3.2196   -15.0486     5.0125	C.2	1	noname	-0.0367
6	C5     1.1136   -15.2916     3.8176	C.2	1	noname	-0.0367
7	C6     2.5225   -15.3186     3.8176	C.2	1	noname	-0.0204
8	N1     3.2095   -15.5975     2.6647	N.3	1	noname	0.0683
9	C7     3.5674   -14.5325     1.8467	C.2	1	noname	0.0429
10	C8     3.5394   -16.9125     2.3227	C.2	1	noname	-0.0107
11	N2     3.2584   -13.2844     2.1588	N.2	1	noname	-0.1411
12	C9     4.2844   -14.7744     0.6398	C.2	1	noname	0.0644
13	C10     4.2554   -17.1654     1.1217	C.2	1	noname	-0.0214
14	C11     3.1944   -18.0294     3.1227	C.2	1	noname	-0.0347
15	C12     3.5744   -12.2324     1.4158	C.2	1	noname	0.1143
16	C13     4.6213   -13.6504    -0.1521	C.2	1	noname	0.0817
17	C14     4.6213   -16.0864     0.2908	C.2	1	noname	0.0136
18	C15     4.6033   -18.4804     0.7498	C.2	1	noname	-0.0134
19	C16     3.5433   -19.3354     2.7468	C.2	1	noname	-0.0243
20	O1     3.2473   -11.0834     1.7779	O.2	1	noname	-0.2481
21	N3     4.2573   -12.4094     0.2578	N.3	1	noname	0.1044
22	O2     5.2503   -13.7624    -1.2270	O.2	1	noname	-0.2831
23	C17     4.2533   -19.5843     1.5548	C.2	1	noname	-0.0224
24	C18     4.6043   -20.9832     1.1899	C.3	1	noname	0.4161
25	F1     5.2932   -21.0982     0.0049	F	1	noname	-0.1661
26	F2     5.3932   -21.5412     2.1669	F	1	noname	-0.1661
27	F3     3.4642   -21.7402     1.0659	F	1	noname	-0.1661
28	H1     3.0366   -14.5647     7.0516	H	1	noname	0.0638
29	H2    -0.6123   -14.9857     4.9826	H	1	noname	0.0638
30	H3     4.2395   -15.0636     5.0226	H	1	noname	0.0640
31	H4     0.5996   -15.4836     2.9576	H	1	noname	0.0640
32	H5     2.6803   -17.9024     3.9948	H	1	noname	0.0639
33	H6     5.1363   -16.2603    -0.5750	H	1	noname	0.0638
34	H7     5.1183   -18.6373    -0.1190	H	1	noname	0.0635
35	H8     3.2753   -20.1153     3.3488	H	1	noname	0.0629
36	H9     4.4873   -11.6394    -0.2840	H	1	noname	0.1424
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	28	1
6	4	6	2
7	4	29	1
8	5	7	2
9	5	30	1
10	6	7	1
11	6	31	1
12	7	8	1
13	8	9	1
14	8	10	1
15	9	11	2
16	9	12	1
17	10	13	2
18	10	14	1
19	11	15	1
20	12	16	1
21	12	17	2
22	13	18	1
23	13	17	1
24	14	19	2
25	14	32	1
26	15	20	2
27	15	21	1
28	16	22	2
29	16	21	1
30	17	33	1
31	18	23	2
32	18	34	1
33	19	23	1
34	19	35	1
35	21	36	1
36	23	24	1
37	24	25	1
38	24	26	1
39	24	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1