@<TRIPOS>MOLECULE
DB04106
38 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -2.3609    -3.6875     2.2201	Cl	1	noname	-0.1251
2	C1    -0.8819    -2.8165     1.8447	C.3	1	noname	0.0377
3	C2    -0.7279    -2.7036     0.3266	C.3	1	noname	0.0465
4	N1     0.4591    -2.0046     0.0254	N.3	1	noname	0.1387
5	N2     1.5361    -2.6315    -0.1228	N.2	1	noname	-0.0566
6	C3     0.4370    -0.6709    -0.1028	C.2	1	noname	0.0360
7	O1     1.5234    -3.7236    -0.5283	O.2	1	noname	-0.1624
8	O2     1.4893    -0.0513    -0.3698	O.2	1	noname	-0.2749
9	N3    -0.7130    -0.0015     0.0554	N.3	1	noname	-0.0467
10	C4    -0.7361     1.4018    -0.0794	C.3	1	noname	0.1199
11	P1    -2.2720     1.9526     0.1659	P	1	noname	0.0322
12	C5     0.2018     2.0290     0.9540	C.3	1	noname	-0.0358
13	O3    -3.1547     1.3623    -0.8067	O.2	1	noname	-0.2230
14	O4    -2.2973     3.4854     0.0187	O.3	1	noname	-0.1789
15	O5    -2.7362     1.5653     1.5823	O.3	1	noname	-0.1789
16	C6    -3.6191     3.9594     0.2298	C.3	1	noname	0.0575
17	C7    -3.3679     0.2942     1.5423	C.3	1	noname	0.0575
18	C8    -3.6442     5.4822     0.0835	C.3	1	noname	-0.0406
19	C9    -3.8291    -0.0907     2.9495	C.3	1	noname	-0.0406
20	H1    -0.9799    -1.7852     2.1835	H	1	noname	0.0449
21	H2    -0.0265    -3.4145     2.1590	H	1	noname	0.0449
22	H3    -0.5822    -3.7061    -0.0756	H	1	noname	0.0470
23	H4    -1.5356    -2.0768    -0.0512	H	1	noname	0.0470
24	H5    -1.5399    -0.5402     0.2704	H	1	noname	0.1336
25	H6    -0.3299     1.5610    -1.0783	H	1	noname	0.0622
26	H7    -0.1525     1.7921     1.9572	H	1	noname	0.0255
27	H8     1.2077     1.6310     0.8205	H	1	noname	0.0255
28	H9     0.2183     3.1107     0.8205	H	1	noname	0.0255
29	H10    -4.2135     3.5327    -0.5781	H	1	noname	0.0573
30	H11    -3.8533     3.7158     1.2661	H	1	noname	0.0573
31	H12    -4.2538     0.4292     0.9218	H	1	noname	0.0573
32	H13    -2.5910    -0.4072     1.2379	H	1	noname	0.0573
33	H14    -3.6518     5.9421     1.0717	H	1	noname	0.0254
34	H15    -2.7595     5.8094    -0.4627	H	1	noname	0.0254
35	H16    -4.5392     5.7800    -0.4627	H	1	noname	0.0254
36	H17    -3.8581    -1.1767     3.0380	H	1	noname	0.0254
37	H18    -3.1331     0.3153     3.6836	H	1	noname	0.0254
38	H19    -4.8245     0.3153     3.1293	H	1	noname	0.0254
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	4	5	1
5	4	6	1
6	5	7	2
7	6	8	2
8	6	9	1
9	10	9	1
10	10	11	1
11	10	12	1
12	11	13	2
13	11	14	1
14	11	15	1
15	14	16	1
16	15	17	1
17	16	18	1
18	17	19	1
19	2	20	1
20	2	21	1
21	3	22	1
22	3	23	1
23	9	24	1
24	10	25	1
25	12	26	1
26	12	27	1
27	12	28	1
28	16	29	1
29	16	30	1
30	17	31	1
31	17	32	1
32	18	33	1
33	18	34	1
34	18	35	1
35	19	36	1
36	19	37	1
37	19	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1