@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442802
33 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    22.1782   -30.5066    -1.3924	Cl	1	noname	-0.0888
2	C1    20.6072   -29.9015    -1.2204	C.2	1	noname	-0.0238
3	C2    20.3451   -28.8555    -0.3203	C.2	1	noname	-0.0122
4	C3    19.5572   -30.4435    -1.9793	C.2	1	noname	-0.0230
5	C4    19.0361   -28.3515    -0.1753	C.2	1	noname	-0.0196
6	C5    18.2542   -29.9415    -1.8362	C.2	1	noname	-0.0330
7	C6    17.9581   -28.8864    -0.9352	C.2	1	noname	-0.0081
8	C7    18.7911   -27.3014     0.7336	C.2	1	noname	0.0142
9	N1    16.6721   -28.3634    -0.7692	N.3	1	noname	0.0790
10	C8    17.5011   -26.7844     0.8907	C.2	1	noname	0.0648
11	C9    16.4290   -27.3284     0.1248	C.2	1	noname	0.0452
12	C10    15.6100   -28.8543    -1.4862	C.2	1	noname	0.0231
13	C11    17.1900   -25.7314     1.7848	C.2	1	noname	0.0817
14	N2    15.2170   -26.8253     0.2878	N.2	1	noname	-0.1408
15	C12    15.2510   -28.2973    -2.7351	C.2	1	noname	0.0287
16	C13    14.8610   -29.9323    -0.9691	C.2	1	noname	-0.0334
17	O1    18.0620   -25.1913     2.5008	O.2	1	noname	-0.2831
18	N3    15.9120   -25.2853     1.8758	N.3	1	noname	0.1044
19	C14    14.9280   -25.8373     1.1239	C.2	1	noname	0.1143
20	F1    15.9259   -27.3012    -3.2380	F	1	noname	-0.1614
21	C15    14.1579   -28.8182    -3.4510	C.2	1	noname	-0.0088
22	C16    13.7700   -30.4492    -1.6881	C.2	1	noname	-0.0630
23	O2    13.7559   -25.4163     1.2209	O.2	1	noname	-0.2481
24	C17    13.4189   -29.8922    -2.9280	C.2	1	noname	-0.0606
25	H1    21.1091   -28.4604     0.2326	H	1	noname	0.0645
26	H2    19.7311   -31.2034    -2.6383	H	1	noname	0.0638
27	H3    17.5161   -30.3574    -2.4042	H	1	noname	0.0640
28	H4    19.5600   -26.9124     1.2837	H	1	noname	0.0638
29	H5    15.1109   -30.3402    -0.0681	H	1	noname	0.0640
30	H6    15.6979   -24.5633     2.4869	H	1	noname	0.1424
31	H7    13.8979   -28.4162    -4.3530	H	1	noname	0.0653
32	H8    13.2329   -31.2291    -1.3080	H	1	noname	0.0623
33	H9    12.6258   -30.2681    -3.4500	H	1	noname	0.0623
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	25	1
6	4	6	2
7	4	26	1
8	5	7	2
9	5	8	1
10	6	7	1
11	6	27	1
12	7	9	1
13	8	10	2
14	8	28	1
15	9	11	1
16	9	12	1
17	10	13	1
18	10	11	1
19	11	14	2
20	12	15	2
21	12	16	1
22	13	17	2
23	13	18	1
24	14	19	1
25	15	20	1
26	15	21	1
27	16	22	2
28	16	29	1
29	18	19	1
30	18	30	1
31	19	23	2
32	21	24	2
33	21	31	1
34	22	24	1
35	22	32	1
36	24	33	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1