@<TRIPOS>MOLECULE
DB03807
34 35 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     1.9065    -0.8126    -1.6295	Cl	1	noname	-0.0767
2	C1     1.3735     0.1949    -0.3858	C.2	1	noname	-0.0017
3	C2     0.1003    -0.0760     0.2498	C.2	1	noname	0.0165
4	C3     2.1871     1.2970     0.0183	C.2	1	noname	-0.0264
5	N1    -0.6572    -1.2179    -0.0142	N.3	1	noname	0.0146
6	C4    -0.3812     0.8427     1.2651	C.2	1	noname	-0.0363
7	C5     1.6803     2.1390     1.0681	C.2	1	noname	-0.0714
8	N2    -1.9369    -1.3451     0.2345	N.2	1	noname	-0.3162
9	C6    -0.2314    -2.3804    -0.5620	C.2	1	noname	-0.0010
10	C7     0.4022     1.9504     1.6913	C.2	1	noname	-0.0561
11	C8    -2.3848    -2.5581    -0.1535	C.2	1	noname	0.0477
12	C9    -1.3040    -3.2529    -0.6671	C.2	1	noname	0.0410
13	C10     1.1385    -2.6694    -0.9761	C.3	1	noname	0.0308
14	C11    -3.7567    -3.0467    -0.0503	C.3	1	noname	0.0483
15	C12    -1.2954    -4.5456    -1.1779	C.2	1	noname	0.1040
16	O1    -2.3516    -5.2135    -1.2062	O.2	1	noname	-0.2543
17	O2    -0.1463    -5.0798    -1.6435	O.3	1	noname	-0.2051
18	C13    -0.1375    -6.4004    -2.1653	C.3	1	noname	0.0539
19	C14     1.2782    -6.7593    -2.6211	C.3	1	noname	-0.0409
20	H1     3.1513     1.4869    -0.4533	H	1	noname	0.0638
21	H2    -1.3603     0.6963     1.7211	H	1	noname	0.0643
22	H3     2.3003     2.9673     1.4111	H	1	noname	0.0623
23	H4     0.0377     2.6273     2.4640	H	1	noname	0.0623
24	H5     1.7646    -2.8015    -0.0937	H	1	noname	0.0294
25	H6     1.1531    -3.5821    -1.5719	H	1	noname	0.0294
26	H7     1.5205    -1.8404    -1.5719	H	1	noname	0.0294
27	H8    -4.0297    -3.1440     1.0005	H	1	noname	0.0296
28	H9    -4.4309    -2.3421    -0.5372	H	1	noname	0.0296
29	H10    -3.8337    -4.0189    -0.5372	H	1	noname	0.0296
30	H11    -0.3960    -7.0463    -1.3262	H	1	noname	0.0570
31	H12    -0.7782    -6.3692    -3.0465	H	1	noname	0.0570
32	H13     1.9112    -6.9197    -1.7483	H	1	noname	0.0254
33	H14     1.2474    -7.6696    -3.2198	H	1	noname	0.0254
34	H15     1.6847    -5.9442    -3.2198	H	1	noname	0.0254
@<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	5	8	1
8	5	9	1
9	6	10	2
10	7	10	1
11	8	11	2
12	9	12	2
13	9	13	1
14	11	14	1
15	11	12	1
16	12	15	1
17	15	16	2
18	15	17	1
19	17	18	1
20	18	19	1
21	4	20	1
22	6	21	1
23	7	22	1
24	10	23	1
25	13	24	1
26	13	25	1
27	13	26	1
28	14	27	1
29	14	28	1
30	14	29	1
31	18	30	1
32	18	31	1
33	19	32	1
34	19	33	1
35	19	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
