@<TRIPOS>MOLECULE
50394885
39 42 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1    -1.3796    -7.2625    -0.7785	F	1	noname	-0.1476
2	C1    -0.3011    -6.6808    -0.3415	C.2	1	noname	0.0563
3	C2     0.8851    -7.3826    -0.1326	C.2	1	noname	0.0856
4	C3    -0.2593    -5.2697    -0.0434	C.2	1	noname	0.0747
5	N1     1.9931    -6.7201     0.3296	N.2	1	noname	-0.2413
6	N2     0.9423    -8.6979    -0.3822	N.3	1	noname	-0.0988
7	N3     0.9028    -4.7020     0.4146	N.2	1	noname	-0.2514
8	C4    -1.4291    -4.4592    -0.2257	C.2	1	noname	0.0024
9	C5     2.0686    -5.3848     0.6219	C.2	1	noname	0.0472
10	C6    -1.4368    -3.0558     0.0595	C.2	1	noname	0.0557
11	C7    -2.6722    -5.0095    -0.7049	C.2	1	noname	-0.0128
12	C8     3.2868    -4.7465     1.1119	C.3	1	noname	0.0651
13	N4    -2.5903    -2.3385    -0.1517	N.2	1	noname	-0.2509
14	N5    -0.3392    -2.4110     0.5536	N.3	1	noname	0.0124
15	C9    -3.8339    -4.2500    -0.8984	C.2	1	noname	-0.0447
16	C10    -3.7603    -2.8691    -0.6069	C.2	1	noname	0.0057
17	C11    -0.3504    -1.0945     0.7854	C.2	1	noname	0.0023
18	C12    -0.0695    -0.1734    -0.2502	C.2	1	noname	0.0043
19	C13    -0.8768    -0.6221     2.0264	C.2	1	noname	-0.0396
20	C14    -0.3545     1.1821    -0.0842	C.2	1	noname	-0.0590
21	C15     0.4269    -0.3155    -1.5462	C.2	1	noname	0.0271
22	C16    -1.1771     0.7556     2.1808	C.2	1	noname	-0.0466
23	N6    -0.0101     1.8146    -1.2099	N.3	1	noname	-0.0266
24	C17    -0.9320     1.6735     1.1209	C.2	1	noname	-0.0486
25	N7     0.4414     0.9314    -2.0557	N.2	1	noname	-0.3151
26	H1     0.0899    -9.2316    -0.4763	H	1	noname	0.1258
27	H2     1.8377    -9.1557    -0.4763	H	1	noname	0.1258
28	H3    -2.7383    -6.0725    -0.9366	H	1	noname	0.0631
29	H4     3.2845    -4.7477     2.2019	H	1	noname	0.0312
30	H5     4.1558    -5.2959     0.7498	H	1	noname	0.0312
31	H6     3.3296    -3.7193     0.7498	H	1	noname	0.0312
32	H7     0.5074    -2.9240     0.7538	H	1	noname	0.1357
33	H8    -4.7528    -4.7121    -1.2591	H	1	noname	0.0639
34	H9    -4.6157    -2.2057    -0.7346	H	1	noname	0.0839
35	H10    -1.0488    -1.3109     2.8534	H	1	noname	0.0639
36	H11     0.7419    -1.2236    -2.0604	H	1	noname	0.0863
37	H12    -1.5994     1.1114     3.1206	H	1	noname	0.0623
38	H13    -0.0801     2.8055    -1.3927	H	1	noname	0.1754
39	H14    -1.1810     2.7291     1.2298	H	1	noname	0.0643
@<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	4	8	1
8	5	9	2
9	7	9	1
10	8	10	2
11	8	11	1
12	9	12	1
13	10	13	1
14	10	14	1
15	11	15	2
16	13	16	2
17	14	17	1
18	15	16	1
19	17	18	2
20	17	19	1
21	18	20	1
22	18	21	1
23	19	22	2
24	20	23	1
25	20	24	2
26	21	25	2
27	22	24	1
28	23	25	1
29	6	26	1
30	6	27	1
31	11	28	1
32	12	29	1
33	12	30	1
34	12	31	1
35	14	32	1
36	15	33	1
37	16	34	1
38	19	35	1
39	21	36	1
40	22	37	1
41	23	38	1
42	24	39	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1