@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=4056
34 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     1.5811     2.5483     4.7487	Cl	1	noname	-0.0766
2	C1     3.0551     2.7263     3.9208	C.2	1	noname	0.0159
3	C2     3.2991     2.1714     2.6338	C.2	1	noname	0.0269
4	C3     4.0631     3.4634     4.5708	C.2	1	noname	-0.0208
5	C4     2.2930     1.4214     1.9688	C.2	1	noname	0.0610
6	C5     4.5680     2.3734     2.0238	C.2	1	noname	0.0159
7	C6     5.3100     3.6554     3.9618	C.2	1	noname	-0.0360
8	C7     2.2059     0.0074     2.0989	C.2	1	noname	0.1122
9	C8     1.3599     2.0805     1.1559	C.2	1	noname	0.0178
10	Cl2     4.9750     1.7604     0.4909	Cl	1	noname	-0.0766
11	C9     5.5610     3.1125     2.6939	C.2	1	noname	-0.0208
12	O1     3.0389    -0.5904     2.8190	O.2	1	noname	-0.2722
13	N1     1.2258    -0.7064     1.4339	N.3	1	noname	-0.0953
14	C10     0.3589     1.3505     0.4849	C.2	1	noname	0.0079
15	C11     0.3048    -0.0533     0.6379	C.2	1	noname	0.0578
16	C12     1.1528    -2.1384     1.5709	C.3	1	noname	0.0987
17	C13    -0.6021     1.9576    -0.3400	C.2	1	noname	0.0250
18	N2    -0.6662    -0.7463    -0.0089	N.2	1	noname	-0.2111
19	C14     1.5238    -2.8073     0.3520	C.2	1	noname	0.1427
20	N3    -1.5412     1.2016    -0.9569	N.2	1	noname	-0.2378
21	C15    -1.5813    -0.1402    -0.7989	C.2	1	noname	0.0862
22	O2     0.7497    -3.5673    -0.2069	O.2	1	noname	-0.2504
23	O3     2.7168    -2.6103    -0.1749	O.3	1	noname	-0.2146
24	N4    -2.5184    -0.8642    -1.4179	N.3	1	noname	-0.0800
25	H1     3.8990     3.8655     5.4958	H	1	noname	0.0638
26	H2     6.0360     4.1885     4.4409	H	1	noname	0.0623
27	H3     1.4039     3.0965     1.0479	H	1	noname	0.0638
28	H4     6.4770     3.2636     2.2659	H	1	noname	0.0638
29	H5     1.8178    -2.5073     2.3530	H	1	noname	0.0548
30	H6     0.1368    -2.4253     1.8520	H	1	noname	0.0548
31	H7    -0.6001     2.9686    -0.4819	H	1	noname	0.0848
32	H8     2.8647    -3.1082    -1.0048	H	1	noname	0.2213
33	H9    -2.5394    -1.8261    -1.3018	H	1	noname	0.1273
34	H10    -3.1724    -0.4251    -1.9828	H	1	noname	0.1273
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	4	25	1
8	5	8	1
9	5	9	2
10	6	10	1
11	6	11	2
12	7	11	1
13	7	26	1
14	8	12	2
15	8	13	1
16	9	14	1
17	9	27	1
18	11	28	1
19	13	15	1
20	13	16	1
21	14	17	1
22	14	15	2
23	15	18	1
24	16	19	1
25	16	29	1
26	16	30	1
27	17	20	2
28	17	31	1
29	18	21	2
30	19	22	2
31	19	23	1
32	20	21	1
33	21	24	1
34	23	32	1
35	24	33	1
36	24	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1