@<TRIPOS>MOLECULE
DB02534
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.3926    -1.2427     0.0616	O.3	1	noname	-0.2846
2	C1     0.1545    -0.0096     0.0104	C.2	1	noname	0.0032
3	C2     1.5065     0.1395    -0.2760	C.2	1	noname	-0.0249
4	C3    -0.6342     1.1109     0.2440	C.2	1	noname	-0.0313
5	C4     2.0698     1.4092    -0.3287	C.2	1	noname	-0.0470
6	C5     2.3349    -1.0374    -0.5213	C.3	1	noname	-0.0074
7	C6    -0.0709     2.3805     0.1912	C.2	1	noname	-0.0524
8	C7     1.2811     2.5297    -0.0952	C.2	1	noname	-0.0721
9	C8     2.8919    -1.4941     0.7140	C.2	1	noname	-0.0926
10	C9     3.6855    -2.5613     0.7314	C.2	1	noname	-0.0973
11	H1    -0.5084    -1.5036     0.9782	H	1	noname	0.2182
12	H2    -1.6944     0.9939     0.4685	H	1	noname	0.0650
13	H3     3.1300     1.5261    -0.5533	H	1	noname	0.0626
14	H4     1.6725    -1.8289    -0.8719	H	1	noname	0.0360
15	H5     3.1745    -0.7163    -1.1378	H	1	noname	0.0360
16	H6    -0.6894     3.2592     0.3743	H	1	noname	0.0623
17	H7     1.7228     3.5253    -0.1365	H	1	noname	0.0622
18	H8     2.7054    -1.0129     1.6741	H	1	noname	0.0573
19	H9     3.2532    -3.5619     0.7385	H	1	noname	0.0534
20	H10     4.7682    -2.4353     0.7385	H	1	noname	0.0534
@<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	5	8	2
8	6	9	1
9	7	8	1
10	9	10	2
11	1	11	1
12	4	12	1
13	5	13	1
14	6	14	1
15	6	15	1
16	7	16	1
17	8	17	1
18	9	18	1
19	10	19	1
20	10	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
