@<TRIPOS>MOLECULE
DB03314
27 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	F1    -0.8415    -3.3518     0.2052	F	1	noname	-0.1647
2	C1    -0.1389    -2.2574     0.1691	C.2	1	noname	0.0315
3	C2    -0.7920    -1.0059    -0.0889	C.2	1	noname	0.0149
4	C3     1.2796    -2.3192     0.3883	C.2	1	noname	0.0044
5	C4     0.0197     0.1615    -0.0911	C.2	1	noname	-0.0188
6	C5     2.0815    -1.1278     0.3790	C.2	1	noname	-0.0266
7	C6     1.4072     0.1055     0.1530	C.2	1	noname	-0.0889
8	C7    -0.3082     1.4798    -0.3662	C.2	1	noname	-0.0355
9	N1     1.8962     1.3497     0.0523	N.3	1	noname	-0.0766
10	C8     0.8901     2.1890    -0.2685	C.2	1	noname	-0.1070
11	C9    -1.6280     2.0137    -0.6899	C.3	1	noname	-0.0011
12	C10    -2.3396     2.4304     0.5989	C.3	1	noname	0.0954
13	N2    -3.6612     2.9651     0.2748	N.3	1	noname	-0.3191
14	C11    -1.5535     3.4553     1.2793	C.2	1	noname	0.1439
15	O1    -1.1252     3.2495     2.4355	O.2	1	noname	-0.2495
16	O2    -1.2890     4.6253     0.6599	O.3	1	noname	-0.2139
17	H1    -1.8641    -0.9444    -0.2761	H	1	noname	0.0660
18	H2     1.7546    -3.2843     0.5642	H	1	noname	0.0653
19	H3     3.1595    -1.1584     0.5372	H	1	noname	0.0643
20	H4     2.8614     1.6111     0.1943	H	1	noname	0.1522
21	H5     1.0230     3.2599    -0.4227	H	1	noname	0.0792
22	H6    -1.4510     2.9163    -1.2748	H	1	noname	0.0338
23	H7    -2.1888     1.1851    -1.1224	H	1	noname	0.0338
24	H8    -2.4689     1.5918     1.2830	H	1	noname	0.0575
25	H9    -3.7896     3.9606     0.1629	H	1	noname	0.1191
26	H10    -4.4457     2.3389     0.1629	H	1	noname	0.1191
27	H11    -1.1348     5.3077     1.3172	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	4	6	2
6	5	7	2
7	5	8	1
8	6	7	1
9	7	9	1
10	8	10	2
11	8	11	1
12	9	10	1
13	11	12	1
14	12	13	1
15	12	14	1
16	14	15	2
17	14	16	1
18	3	17	1
19	4	18	1
20	6	19	1
21	9	20	1
22	10	21	1
23	11	22	1
24	11	23	1
25	12	24	1
26	13	25	1
27	13	26	1
28	16	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1