@<TRIPOS>MOLECULE
71587610
38 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	S1     0.1182     3.5039    -2.3090	S.3	1	noname	-0.2001
2	F1     1.3453     7.7154    -7.3085	F	1	noname	-0.1655
3	O1     3.9863     3.3368    -3.7992	O.3	1	noname	-0.3827
4	O2    -4.2518     3.1686     0.5139	O.3	1	noname	-0.3029
5	O3    -5.7094     5.3778     0.1710	O.2	1	noname	-0.2794
6	N1    -3.9837     4.2635     1.1926	N.3	1	noname	0.0260
7	N2    -5.1373     6.1925     2.1536	N.3	1	noname	-0.0697
8	C1     2.5580     3.3787    -3.9273	C.3	1	noname	0.1134
9	C2     2.2532     4.5247    -4.8322	C.2	1	noname	-0.0428
10	C3     1.8584     3.4496    -2.6049	C.2	1	noname	0.0236
11	C4     2.4699     3.6368    -1.3614	C.2	1	noname	-0.0090
12	C5     2.7805     4.5771    -6.1500	C.2	1	noname	-0.0311
13	C6     1.4419     5.6167    -4.4241	C.2	1	noname	-0.0311
14	C7     0.2273     3.8595    -0.5970	C.2	1	noname	0.0472
15	C8     1.5898     3.8380    -0.2833	C.2	1	noname	-0.0070
16	C9    -2.7063     4.2956     1.9137	C.3	1	noname	0.1029
17	C10     2.4774     5.6647    -6.9970	C.2	1	noname	-0.0046
18	C11     1.1085     6.6729    -5.2573	C.2	1	noname	-0.0046
19	C12     1.6387     6.7059    -6.5505	C.2	1	noname	0.0235
20	C13    -2.4010     5.5805     2.7604	C.3	1	noname	-0.0353
21	C14    -0.7643     4.0208     0.2265	C.1	1	noname	-0.0164
22	C15    -1.6667     4.1432     1.0078	C.1	1	noname	-0.0590
23	C16    -4.9729     5.2526     1.1817	C.2	1	noname	0.0024
24	H1     2.2433     2.4651    -4.4334	H	1	noname	0.0712
25	H2     3.4888     3.6416    -1.2443	H	1	noname	0.0635
26	H3     3.3948     3.8319    -6.5013	H	1	noname	0.0627
27	H4     1.0626     5.7053    -3.4929	H	1	noname	0.0627
28	H5     1.9406     3.9308     0.6696	H	1	noname	0.0644
29	H6    -2.6987     3.4568     2.6280	H	1	noname	0.0634
30	H7     2.8629     5.7043    -7.9413	H	1	noname	0.0653
31	H8     0.4933     7.4058    -4.8857	H	1	noname	0.0653
32	H9     4.1867     2.5768    -3.2179	H	1	noname	0.2114
33	H10    -1.3888     5.7284     3.1716	H	1	noname	0.0257
34	H11    -3.1261     5.5929     3.5915	H	1	noname	0.0257
35	H12    -2.5804     6.4384     2.1124	H	1	noname	0.0257
36	H13    -4.7296     2.5359     1.0900	H	1	noname	0.2384
37	H14    -6.0103     6.5416     2.4285	H	1	noname	0.1285
38	H15    -4.3337     6.4969     2.5985	H	1	noname	0.1285
@<TRIPOS>BOND
1	1	10	1
2	1	14	1
3	2	19	1
4	3	8	1
5	3	32	1
6	4	6	1
7	4	36	1
8	5	23	2
9	16	6	1
10	6	23	1
11	7	23	1
12	7	37	1
13	7	38	1
14	8	9	1
15	8	10	1
16	8	24	1
17	9	12	2
18	9	13	1
19	10	11	2
20	11	15	1
21	11	25	1
22	12	17	1
23	12	26	1
24	13	18	2
25	13	27	1
26	14	15	2
27	14	21	1
28	15	28	1
29	16	20	1
30	16	22	1
31	16	29	1
32	17	19	2
33	17	30	1
34	18	19	1
35	18	31	1
36	20	33	1
37	20	34	1
38	20	35	1
39	21	22	3
@<TRIPOS>SUBSTRUCTURE
1	noname	1