@<TRIPOS>MOLECULE
DB07021
36 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1     7.7550     5.2970    -1.4325	F	1	noname	-0.1502
2	C1     6.8113     4.5177    -0.9912	C.2	1	noname	0.0777
3	C2     6.0960     4.8687     0.1478	C.2	1	noname	0.0647
4	C3     6.5182     3.3342    -1.6587	C.2	1	noname	0.0561
5	F2     6.3702     5.9765     0.7725	F	1	noname	-0.1525
6	C4     5.0877     4.0362     0.6193	C.2	1	noname	0.0213
7	C5     5.5099     2.5017    -1.1872	C.2	1	noname	0.0316
8	C6     4.7946     2.8527    -0.0482	C.2	1	noname	0.0097
9	F3     5.2357     1.3939    -1.8119	F	1	noname	-0.1640
10	C7     3.6844     1.9359     0.4710	C.3	1	noname	0.0481
11	C8     4.3176     0.5452     0.8095	C.3	1	noname	0.0278
12	C9     2.4848     1.9311    -0.5273	C.3	1	noname	0.0501
13	N1     4.5883     0.4714     2.2506	N.3	1	noname	-0.3257
14	C10     3.4636    -0.7091     0.4208	C.3	1	noname	-0.0419
15	C11     1.5753     0.7927    -0.1746	C.2	1	noname	-0.0461
16	N2     2.0560    -0.3719     0.3322	N.3	1	noname	-0.0247
17	N3     0.2279     0.8374    -0.1450	N.2	1	noname	-0.2329
18	C12     1.0036    -1.0512     0.8125	C.2	1	noname	0.0392
19	C13    -0.1386    -0.2991     0.4619	C.2	1	noname	0.0267
20	C14     0.9671    -2.2353     1.5956	C.2	1	noname	-0.0122
21	C15    -1.4254    -0.7357     0.8567	C.2	1	noname	0.0355
22	C16    -0.3352    -2.6377     1.9942	C.2	1	noname	-0.0033
23	N4    -1.4306    -1.8827     1.6071	N.2	1	noname	-0.2725
24	H1     7.0792     3.0590    -2.5518	H	1	noname	0.0685
25	H2     4.5267     4.3114     1.5124	H	1	noname	0.0658
26	H3     3.2560     2.3130     1.3996	H	1	noname	0.0374
27	H4     5.2568     0.4970     0.2583	H	1	noname	0.0485
28	H5     1.9119     2.8432    -0.3599	H	1	noname	0.0352
29	H6     2.8807     1.7104    -1.5186	H	1	noname	0.0352
30	H7     5.5411     0.4460     2.5848	H	1	noname	0.1187
31	H8     3.8218     0.4460     2.9078	H	1	noname	0.1187
32	H9     3.7476    -1.0060    -0.5888	H	1	noname	0.0489
33	H10     3.5321    -1.4258     1.2392	H	1	noname	0.0489
34	H11     1.8649    -2.7899     1.8684	H	1	noname	0.0659
35	H12    -2.3518    -0.2222     0.5996	H	1	noname	0.0863
36	H13    -0.4947    -3.5297     2.5999	H	1	noname	0.0839
@<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	6	8	2
8	7	9	1
9	7	8	1
10	10	8	1
11	10	11	1
12	10	12	1
13	11	13	1
14	11	14	1
15	12	15	1
16	14	16	1
17	15	17	2
18	15	16	1
19	16	18	1
20	17	19	1
21	18	20	1
22	18	19	2
23	19	21	1
24	20	22	2
25	21	23	2
26	22	23	1
27	4	24	1
28	6	25	1
29	10	26	1
30	11	27	1
31	12	28	1
32	12	29	1
33	13	30	1
34	13	31	1
35	14	32	1
36	14	33	1
37	20	34	1
38	21	35	1
39	22	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
