@<TRIPOS>MOLECULE
DB07030
38 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     1.2821    -2.0364    -0.5976	Cl	1	noname	-0.0786
2	C1     1.2809    -0.3494    -0.5979	C.2	1	noname	0.0099
3	C2     1.7248     0.3462     0.5207	C.2	1	noname	0.0154
4	C3     0.8360     0.3451    -1.7168	C.2	1	noname	-0.0256
5	C4     1.7238     1.7362     0.5204	C.2	1	noname	0.0483
6	C5     0.8350     1.7351    -1.7171	C.2	1	noname	-0.0005
7	O1     2.1549     2.4117     1.6068	O.3	1	noname	-0.2583
8	C6     1.2789     2.4306    -0.5985	C.2	1	noname	0.0183
9	C7     3.5502     2.6493     1.4935	C.3	1	noname	0.1390
10	C8     1.2779     3.8206    -0.5987	C.2	1	noname	0.0226
11	C9     4.0165     3.3799     2.6685	C.2	1	noname	0.1487
12	O2     1.4344     4.4455    -1.6699	O.2	1	noname	-0.2934
13	N1     1.1091     4.4907     0.5493	N.3	1	noname	-0.0727
14	O3     4.5455     4.5047     2.5359	O.2	1	noname	-0.2461
15	O4     3.8763     2.8407     3.8982	O.3	1	noname	-0.2113
16	C10     1.1081     5.9007     0.5491	C.3	1	noname	0.0282
17	C11     0.9082     6.3875     1.9109	C.2	1	noname	-0.0205
18	C12     0.8703     7.7541     2.1620	C.2	1	noname	0.0342
19	C13     0.7556     5.4843     2.9565	C.2	1	noname	-0.0187
20	C14     0.6800     8.2176     3.4586	C.2	1	noname	0.0368
21	C15     0.5653     5.9478     4.2530	C.2	1	noname	-0.0313
22	N2     0.6445     9.5006     3.6943	N.2	1	noname	-0.0153
23	C16     0.5275     7.3144     4.5041	C.2	1	noname	0.0264
24	O5     0.2540    10.2325     2.8763	O.2	1	noname	-0.1447
25	O6     1.0341     9.9496     4.8109	O.3	1	noname	-0.1447
26	H1     2.0736    -0.1984     1.3981	H	1	noname	0.0666
27	H2     0.4879    -0.2003    -2.5940	H	1	noname	0.0638
28	H3     0.4861     2.2797    -2.5945	H	1	noname	0.0632
29	H4     4.0296     1.6705     1.5102	H	1	noname	0.0682
30	H5     3.6799     3.3051     0.6326	H	1	noname	0.0682
31	H6     0.9860     3.9477     1.3920	H	1	noname	0.1317
32	H7     3.8840     1.8831     3.8304	H	1	noname	0.2213
33	H8     2.1075     6.2050     0.2381	H	1	noname	0.0483
34	H9     0.2395     6.2036    -0.0357	H	1	noname	0.0483
35	H10     0.9900     8.4624     1.3421	H	1	noname	0.0650
36	H11     0.7853     4.4127     2.7596	H	1	noname	0.0626
37	H12     0.4457     5.2395     5.0729	H	1	noname	0.0623
38	H13     0.3782     7.6778     5.5208	H	1	noname	0.0647
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	4	6	2
6	5	7	1
7	5	8	2
8	6	8	1
9	7	9	1
10	8	10	1
11	9	11	1
12	10	12	2
13	10	13	1
14	11	14	2
15	11	15	1
16	13	16	1
17	16	17	1
18	17	18	2
19	17	19	1
20	18	20	1
21	19	21	2
22	20	22	1
23	20	23	2
24	21	23	1
25	22	24	2
26	22	25	1
27	3	26	1
28	4	27	1
29	6	28	1
30	9	29	1
31	9	30	1
32	13	31	1
33	15	32	1
34	16	33	1
35	16	34	1
36	18	35	1
37	19	36	1
38	21	37	1
39	23	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1