@<TRIPOS>MOLECULE
http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50442801
33 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     6.3454   -28.1486    -0.5277	Cl	1	noname	-0.0798
2	C1     5.4204   -27.7105     0.8303	C.2	1	noname	-0.0019
3	C2     5.0463   -26.3735     1.1413	C.2	1	noname	0.0000
4	C3     5.0193   -28.7625     1.6723	C.2	1	noname	-0.0397
5	C4     4.2673   -26.0964     2.3054	C.2	1	noname	-0.0058
6	C5     5.4283   -25.2814     0.3204	C.2	1	noname	0.0223
7	C6     4.2553   -28.5035     2.8154	C.2	1	noname	-0.0505
8	N1     3.9012   -24.7784     2.6094	N.3	1	noname	0.0690
9	C7     3.8852   -27.1884     3.1254	C.2	1	noname	-0.0426
10	C8     5.0582   -23.9694     0.6314	C.2	1	noname	0.0660
11	C9     4.2822   -23.7223     1.7965	C.2	1	noname	0.0432
12	C10     3.1522   -24.4853     3.7215	C.2	1	noname	-0.0204
13	C11     5.4182   -22.8513    -0.1594	C.2	1	noname	0.0818
14	N2     3.9411   -22.4743     2.0755	N.2	1	noname	-0.1410
15	C12     1.7451   -24.4563     3.6445	C.2	1	noname	-0.0366
16	C13     3.7831   -24.2023     4.9495	C.2	1	noname	-0.0366
17	O1     6.0992   -22.9683    -1.2024	O.2	1	noname	-0.2831
18	N3     5.0182   -21.6093     0.2135	N.3	1	noname	0.1045
19	C14     4.2781   -21.4273     1.3346	C.2	1	noname	0.1143
20	C15     0.9781   -24.1493     4.7816	C.2	1	noname	-0.0248
21	C16     3.0171   -23.8952     6.0876	C.2	1	noname	-0.0248
22	O2     3.9171   -20.2782     1.6646	O.2	1	noname	-0.2481
23	C17     1.6120   -23.8672     6.0066	C.2	1	noname	-0.0275
24	Cl2     0.6890   -23.4952     7.3747	Cl	1	noname	-0.0895
25	H1     5.2793   -29.7285     1.4634	H	1	noname	0.0638
26	H2     5.9862   -25.4394    -0.5195	H	1	noname	0.0639
27	H3     3.9672   -29.2714     3.4224	H	1	noname	0.0623
28	H4     3.3282   -27.0373     3.9665	H	1	noname	0.0639
29	H5     1.2781   -24.6583     2.7596	H	1	noname	0.0640
30	H6     4.8011   -24.2183     5.0156	H	1	noname	0.0640
31	H7     5.2631   -20.8442    -0.3273	H	1	noname	0.1424
32	H8    -0.0409   -24.1322     4.7086	H	1	noname	0.0638
33	H9     3.4900   -23.6912     6.9696	H	1	noname	0.0638
@<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	2
11	6	26	1
12	7	9	1
13	7	27	1
14	8	11	1
15	8	12	1
16	9	28	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	29	1
27	16	21	2
28	16	30	1
29	18	19	1
30	18	31	1
31	19	22	2
32	20	23	2
33	20	32	1
34	21	23	1
35	21	33	1
36	23	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1