@<TRIPOS>MOLECULE
DB02435
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -1.5332    -1.4873     0.8811	N.4	1	noname	-0.0091
2	C1    -0.6416    -0.5006     1.4885	C.3	1	noname	-0.0107
3	C2     0.1154     0.2476     0.3893	C.3	1	noname	0.0070
4	C3     0.9594    -0.7722    -0.4511	C.3	1	noname	-0.0443
5	C4     0.8692     1.4737     1.0149	C.3	1	noname	-0.0443
6	C5     2.2898    -0.2021    -1.0279	C.3	1	noname	-0.0528
7	C6     2.4063     1.2739     1.1922	C.3	1	noname	-0.0528
8	C7     3.1498     0.6451    -0.0315	C.3	1	noname	-0.0532
9	H1    -2.0037    -2.0081     1.6075	H	1	noname	0.2554
10	H2    -2.2178    -1.0149     0.3082	H	1	noname	0.2554
11	H3    -0.9940    -2.1207     0.3082	H	1	noname	0.2554
12	H4    -1.2880     0.2190     1.9909	H	1	noname	0.0942
13	H5     0.0897    -1.0698     2.0623	H	1	noname	0.0942
14	H6    -0.5711     0.6899    -0.3326	H	1	noname	0.0369
15	H7     1.2564    -1.5557     0.2460	H	1	noname	0.0272
16	H8     0.3475    -1.0181    -1.3190	H	1	noname	0.0272
17	H9     0.7616     2.2857     0.2957	H	1	noname	0.0272
18	H10     0.4709     1.5828     2.0237	H	1	noname	0.0272
19	H11     2.8971    -1.0744    -1.2695	H	1	noname	0.0267
20	H12     1.9904     0.4888    -1.8160	H	1	noname	0.0267
21	H13     2.8185     2.2772     1.2997	H	1	noname	0.0267
22	H14     2.5132     0.5512     2.0012	H	1	noname	0.0267
23	H15     3.8621    -0.0584     0.3995	H	1	noname	0.0266
24	H16     3.5069     1.4942    -0.6141	H	1	noname	0.0266
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	1
4	3	5	1
5	4	6	1
6	5	7	1
7	6	8	1
8	7	8	1
9	1	9	1
10	1	10	1
11	1	11	1
12	2	12	1
13	2	13	1
14	3	14	1
15	4	15	1
16	4	16	1
17	5	17	1
18	5	18	1
19	6	19	1
20	6	20	1
21	7	21	1
22	7	22	1
23	8	23	1
24	8	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
