@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50441142
36 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    68.6465   -11.2527     0.0000	Cl	1	noname	-0.0771
2	C1    70.1635   -11.9776     0.1820	C.2	1	noname	0.0048
3	C2    71.3414   -11.2396    -0.0248	C.2	1	noname	0.0142
4	C3    70.2745   -13.3316     0.5420	C.2	1	noname	0.0195
5	N1    72.5464   -11.8425     0.1291	N.2	1	noname	-0.2354
6	C4    71.5384   -13.9286     0.6841	C.2	1	noname	0.0424
7	C5    72.6933   -13.1495     0.4761	C.2	1	noname	0.0570
8	O1    71.6273   -15.2395     1.0341	O.3	1	noname	-0.2589
9	N2    73.9013   -13.7374     0.6332	N.3	1	noname	0.0582
10	C6    71.8693   -16.1994     0.0022	C.3	1	noname	0.0786
11	C7    75.1022   -13.1443     0.4663	C.2	1	noname	0.0930
12	C8    72.0203   -17.5334     0.6082	C.2	1	noname	-0.0434
13	S1    75.3442   -11.4873     0.0083	S.3	1	noname	-0.2183
14	N3    76.2252   -13.8533     0.6553	N.2	1	noname	-0.2209
15	C9    71.1212   -18.5754     0.3023	C.2	1	noname	-0.0497
16	C10    73.0792   -17.7783     1.5053	C.2	1	noname	-0.0497
17	C11    77.0401   -11.8162     0.0873	C.2	1	noname	0.0048
18	C12    77.3292   -13.1252     0.4484	C.2	1	noname	0.0292
19	C13    71.2771   -19.8433     0.8883	C.2	1	noname	-0.0585
20	C14    73.2372   -19.0463     2.0913	C.2	1	noname	-0.0585
21	C15    78.6791   -13.6762     0.5924	C.3	1	noname	0.0385
22	C16    72.3351   -20.0782     1.7834	C.2	1	noname	-0.0611
23	H1    71.3014   -10.2535    -0.2868	H	1	noname	0.0855
24	H2    69.4364   -13.8936     0.7001	H	1	noname	0.0667
25	H3    73.9063   -14.6723     0.8902	H	1	noname	0.1382
26	H4    71.0343   -16.1894    -0.7027	H	1	noname	0.0623
27	H5    72.7853   -15.9544    -0.5407	H	1	noname	0.0623
28	H6    70.3492   -18.4123    -0.3446	H	1	noname	0.0626
29	H7    73.7361   -17.0313     1.7353	H	1	noname	0.0626
30	H8    77.7541   -11.1162    -0.1105	H	1	noname	0.0759
31	H9    70.6221   -20.5923     0.6644	H	1	noname	0.0622
32	H10    74.0051   -19.2162     2.7404	H	1	noname	0.0622
33	H11    78.8041   -14.5091    -0.0994	H	1	noname	0.0296
34	H12    78.8140   -14.0351     1.6135	H	1	noname	0.0296
35	H13    79.4330   -12.9171     0.3785	H	1	noname	0.0296
36	H14    72.4480   -20.9992     2.2095	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	23	1
6	4	6	2
7	4	24	1
8	5	7	2
9	6	8	1
10	6	7	1
11	7	9	1
12	8	10	1
13	9	11	1
14	9	25	1
15	10	12	1
16	10	26	1
17	10	27	1
18	11	13	1
19	11	14	2
20	12	15	2
21	12	16	1
22	13	17	1
23	14	18	1
24	15	19	1
25	15	28	1
26	16	20	2
27	16	29	1
28	17	18	2
29	17	30	1
30	18	21	1
31	19	22	2
32	19	31	1
33	20	22	1
34	20	32	1
35	21	33	1
36	21	34	1
37	21	35	1
38	22	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1