@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50444553
33 35 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    15.6205    -9.3343     4.9238	Cl	1	noname	-0.0778
2	C1    15.8064   -10.6023     3.8098	C.2	1	noname	0.0144
3	C2    15.8214   -10.4352     2.3918	C.2	1	noname	0.0034
4	C3    15.9384   -11.8832     4.3859	C.2	1	noname	0.0188
5	C4    15.9174   -11.6122     1.6088	C.2	1	noname	-0.0238
6	C5    15.6714    -9.1001     1.6968	C.3	1	noname	0.1520
7	C6    16.0644   -13.0272     3.5799	C.2	1	noname	0.0049
8	C7    16.0453   -12.8852     2.1839	C.2	1	noname	-0.0111
9	N1    14.2813    -8.8031     1.5839	N.3	1	noname	-0.0309
10	C8    16.4533    -8.0381     2.3068	C.2	1	noname	0.1540
11	C9    16.0413    -9.0701     0.1658	C.3	1	noname	-0.0119
12	C10    16.1833   -14.2052     4.1179	C.1	1	noname	0.0614
13	C11    13.7833    -8.8960     0.3669	C.2	1	noname	-0.0587
14	C12    13.2702    -8.4941     2.4149	C.2	1	noname	-0.0424
15	O1    17.6643    -8.1730     2.4119	O.2	1	noname	-0.2438
16	O2    15.8653    -6.8900     2.6459	O.3	1	noname	-0.2013
17	C13    14.7442    -9.2481    -0.6550	C.3	1	noname	-0.0099
18	N2    16.2883   -15.2451     4.5930	N.1	1	noname	-0.1839
19	C14    12.4222    -8.6490     0.4189	C.2	1	noname	0.0144
20	N3    12.1242    -8.3950     1.7069	N.2	1	noname	-0.2391
21	C15    16.6282    -5.8650     3.2840	C.3	1	noname	0.0454
22	H1    15.9363   -11.9861     5.4059	H	1	noname	0.0652
23	H2    15.8793   -11.5622     0.5939	H	1	noname	0.0627
24	H3    16.1173   -13.7022     1.5729	H	1	noname	0.0636
25	H4    16.4423    -8.0890    -0.1050	H	1	noname	0.0301
26	H5    16.7963    -9.8071    -0.1070	H	1	noname	0.0301
27	H6    13.3472    -8.3600     3.4220	H	1	noname	0.1015
28	H7    14.6062   -10.2791    -0.9810	H	1	noname	0.0330
29	H8    14.7102    -8.5570    -1.4980	H	1	noname	0.0330
30	H9    11.7711    -8.6590    -0.3660	H	1	noname	0.0856
31	H10    15.9792    -5.0139     3.4900	H	1	noname	0.0536
32	H11    17.0382    -6.2369     4.2240	H	1	noname	0.0536
33	H12    17.4432    -5.5439     2.6340	H	1	noname	0.0536
@<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	22	1
8	5	8	2
9	5	23	1
10	6	9	1
11	6	10	1
12	6	11	1
13	7	12	1
14	7	8	1
15	8	24	1
16	9	13	1
17	9	14	1
18	10	15	2
19	10	16	1
20	11	17	1
21	11	25	1
22	11	26	1
23	12	18	3
24	13	19	2
25	13	17	1
26	14	20	2
27	14	27	1
28	16	21	1
29	17	28	1
30	17	29	1
31	19	20	1
32	19	30	1
33	21	31	1
34	21	32	1
35	21	33	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1