@<TRIPOS>MOLECULE
73425443
25 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.9578    -0.8429    -0.6581	O.3	1	noname	-0.3780
2	O2     0.3609     1.8134     0.0588	O.3	1	noname	-0.3876
3	O3    -0.2031     2.6866    -2.5577	O.3	1	noname	-0.3905
4	O4    -0.8204    -3.4451    -1.9451	O.2	1	noname	-0.3055
5	C1    -0.4988     1.0717    -0.7940	C.3	1	noname	0.1062
6	C2    -0.3831    -0.4179    -0.4643	C.3	1	noname	0.0922
7	C3    -0.0958     1.3041    -2.2516	C.3	1	noname	0.0798
8	C4    -1.3093    -1.2170    -1.3831	C.3	1	noname	0.0320
9	C5     1.3491     0.8462    -2.4605	C.3	1	noname	-0.0363
10	C6    -1.1990    -2.6384    -1.0685	C.2	1	noname	0.1247
11	C7     1.8175    -0.1011     0.1947	C.3	1	noname	0.0361
12	H1    -1.5281     1.3979    -0.6452	H	1	noname	0.0655
13	H2    -0.6702    -0.5834     0.5741	H	1	noname	0.0635
14	H3    -0.7556     0.7348    -2.9062	H	1	noname	0.0625
15	H4    -2.3387    -0.8908    -1.2343	H	1	noname	0.0371
16	H5    -1.0222    -1.0514    -2.4215	H	1	noname	0.0371
17	H6     1.4315    -0.2150    -2.2255	H	1	noname	0.0257
18	H7     1.6362     1.0118    -3.4989	H	1	noname	0.0257
19	H8     2.0089     1.4156    -1.8058	H	1	noname	0.0257
20	H9     0.2868     2.7675    -0.1524	H	1	noname	0.2106
21	H10    -1.1285     2.9799    -2.4239	H	1	noname	0.2105
22	H11    -1.4308    -2.9732    -0.1333	H	1	noname	0.1042
23	H12     2.8468    -0.4274     0.0459	H	1	noname	0.0529
24	H13     1.5304    -0.2667     1.2331	H	1	noname	0.0529
25	H14     1.7351     0.9601    -0.0402	H	1	noname	0.0529
@<TRIPOS>BOND
1	6	1	1
2	1	11	1
3	5	2	1
4	2	20	1
5	7	3	1
6	3	21	1
7	4	10	2
8	5	6	1
9	5	7	1
10	5	12	1
11	6	8	1
12	6	13	1
13	7	9	1
14	7	14	1
15	8	10	1
16	8	15	1
17	8	16	1
18	9	17	1
19	9	18	1
20	9	19	1
21	10	22	1
22	11	23	1
23	11	24	1
24	11	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1