@<TRIPOS>MOLECULE
125247
34 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     4.1048    -6.7882    -0.0000	Cl	1	noname	-0.0489
2	C1     3.5563    -5.1928    -0.0000	C.2	1	noname	0.0184
3	N1     4.4766    -4.1603    -0.0000	N.2	1	noname	-0.2249
4	C2     2.1645    -4.9388    -0.0000	C.2	1	noname	0.0041
5	C3     4.1190    -2.8175    -0.0000	C.2	1	noname	0.0076
6	C4     1.8135    -3.5531    -0.0000	C.2	1	noname	-0.0273
7	C5     2.7228    -2.4676    -0.0000	C.2	1	noname	0.0047
8	N2     2.3316    -1.1529     0.0000	N.3	1	noname	0.0151
9	C6     1.2826    -0.2141     0.0000	C.2	1	noname	0.0624
10	N3     1.9684     0.9797     0.0000	N.2	1	noname	-0.2486
11	C7    -0.1727    -0.1555     0.0000	C.2	1	noname	0.0100
12	C8     1.3964     2.2214     0.0000	C.2	1	noname	0.0086
13	C9    -1.1670    -1.1797     0.0000	C.2	1	noname	0.0827
14	C10    -0.7488     1.1643    -0.0000	C.2	1	noname	-0.0056
15	C11    -0.0033     2.3534    -0.0000	C.2	1	noname	-0.0421
16	N4    -2.5188    -0.8835    -0.0000	N.2	1	noname	-0.2174
17	N5    -0.8093    -2.4901     0.0000	N.2	1	noname	-0.2388
18	C12    -3.4707    -1.8526    -0.0000	C.2	1	noname	0.0964
19	C13    -1.7526    -3.4778     0.0000	C.2	1	noname	0.0686
20	N6    -3.0706    -3.1400     0.0000	N.2	1	noname	-0.2276
21	N7    -4.7730    -1.5373    -0.0000	N.3	1	noname	-0.0771
22	C14    -1.3509    -4.8814     0.0000	C.3	1	noname	0.0696
23	H1     1.4267    -5.7412    -0.0000	H	1	noname	0.0655
24	H2     4.9068    -2.0642    -0.0000	H	1	noname	0.0856
25	H3     0.7531    -3.3006    -0.0000	H	1	noname	0.0641
26	H4     3.2085    -0.6517     0.0000	H	1	noname	0.1358
27	H5     2.0482     3.0952    -0.0000	H	1	noname	0.0839
28	H6    -1.8335     1.2717    -0.0000	H	1	noname	0.0631
29	H7    -0.4870     3.3302    -0.0000	H	1	noname	0.0639
30	H8    -5.0580    -0.5683    -0.0000	H	1	noname	0.1273
31	H9    -5.4697    -2.2685    -0.0000	H	1	noname	0.1273
32	H10    -1.2510    -5.2307     1.0277	H	1	noname	0.0312
33	H11    -2.1066    -5.4756    -0.5138	H	1	noname	0.0312
34	H12    -0.3953    -4.9859    -0.5138	H	1	noname	0.0312
@<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	2
7	6	7	1
8	7	8	1
9	8	9	1
10	9	10	2
11	9	11	1
12	10	12	1
13	11	13	1
14	11	14	2
15	12	15	2
16	13	16	2
17	13	17	1
18	14	15	1
19	16	18	1
20	17	19	2
21	18	20	2
22	18	21	1
23	19	22	1
24	19	20	1
25	4	23	1
26	5	24	1
27	6	25	1
28	8	26	1
29	12	27	1
30	14	28	1
31	15	29	1
32	21	30	1
33	21	31	1
34	22	32	1
35	22	33	1
36	22	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1