@<TRIPOS>MOLECULE
DB03863
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.0043     0.1011     0.2197	O.3	1	noname	-0.3442
2	C1     1.3213    -0.2226    -0.3112	C.3	1	noname	0.1839
3	C2    -0.5374     1.4609     0.1157	C.3	1	noname	0.0866
4	O2     1.9150    -1.2376     0.4849	O.3	1	noname	-0.3656
5	C3     2.3132     0.9680    -0.4587	C.3	1	noname	0.1362
6	C4     0.0773     2.3591    -0.9977	C.3	1	noname	0.1087
7	C5    -0.4075     2.1643     1.4682	C.3	1	noname	-0.0359
8	O3     3.4015     0.5780    -1.2832	O.3	1	noname	-0.3732
9	C6     1.6317     2.2358    -1.0619	C.3	1	noname	0.1136
10	O4    -0.2809     3.7133    -0.7649	O.3	1	noname	-0.3875
11	C7     4.3064     1.6641    -1.4178	C.3	1	noname	0.0363
12	O5     2.2224     3.4009    -0.5050	O.3	1	noname	-0.3873
13	H1     1.1043    -0.6391    -1.2948	H	1	noname	0.0949
14	H2    -1.5730     1.2647    -0.1622	H	1	noname	0.0629
15	H3     1.7926    -1.0283     1.4138	H	1	noname	0.2134
16	H4     2.7556     1.2044     0.5091	H	1	noname	0.0685
17	H5    -0.3610     2.1085    -1.9638	H	1	noname	0.0656
18	H6    -0.3315     1.4188     2.2597	H	1	noname	0.0258
19	H7     0.4867     2.7877     1.4691	H	1	noname	0.0258
20	H8    -1.2851     2.7877     1.6393	H	1	noname	0.0258
21	H9     1.8766     2.2180    -2.1239	H	1	noname	0.0658
22	H10    -0.3237     3.8750     0.1804	H	1	noname	0.2106
23	H11     4.6002     2.0168    -0.4292	H	1	noname	0.0529
24	H12     5.1905     1.3349    -1.9637	H	1	noname	0.0529
25	H13     3.8230     2.4742    -1.9637	H	1	noname	0.0529
26	H14     2.1950     3.3469     0.4530	H	1	noname	0.2106
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	1
6	3	7	1
7	5	8	1
8	5	9	1
9	6	10	1
10	6	9	1
11	8	11	1
12	9	12	1
13	2	13	1
14	3	14	1
15	4	15	1
16	5	16	1
17	6	17	1
18	7	18	1
19	7	19	1
20	7	20	1
21	9	21	1
22	10	22	1
23	11	23	1
24	11	24	1
25	11	25	1
26	12	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1