@<TRIPOS>MOLECULE
73415777
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.4357     0.1241     0.6028	O.3	1	noname	-0.2321
2	O2    -0.5276     1.8423    -0.6494	O.3	1	noname	-0.2323
3	O3     2.6337    -0.0821     1.9053	O.3	1	noname	-0.3870
4	O4     4.3401     1.8990     2.7970	O.3	1	noname	-0.3798
5	O5     0.6209     4.9075     0.2179	O.3	1	noname	-0.3935
6	O6    -0.5284    -0.4623    -1.6182	O.3	1	noname	-0.2487
7	O7     3.0912     4.0928     4.2347	O.3	1	noname	-0.2099
8	O8     1.9672     4.2064     2.4068	O.2	1	noname	-0.2443
9	C1     0.7656     1.3261     1.3190	C.3	1	noname	0.1020
10	C2     0.1011     2.4651     0.4500	C.3	1	noname	0.0965
11	C3     2.3101     1.2898     1.6348	C.3	1	noname	0.1168
12	C4     2.9204     2.0409     2.8750	C.3	1	noname	0.1677
13	C5     0.9951     3.5797    -0.1775	C.3	1	noname	0.0706
14	C6     2.6281     3.4615     3.1304	C.2	1	noname	0.1513
15	B1     0.2986     0.5674    -0.8458	B	1	noname	0.1902
16	H1     0.2433     1.2375     2.2703	H	1	noname	0.0644
17	H2    -0.6834     2.9307     1.0230	H	1	noname	0.0639
18	H3     2.8639     1.5535     0.7348	H	1	noname	0.0661
19	H4     2.6350     1.5309     3.7891	H	1	noname	0.0739
20	H5     0.9636     3.5018    -1.2643	H	1	noname	0.0591
21	H6     2.0157     3.4311     0.1752	H	1	noname	0.0591
22	H7     2.1105    -0.3962     2.6721	H	1	noname	0.2107
23	H8     4.6625     2.2953     1.9607	H	1	noname	0.2113
24	H9     1.2188     5.5562    -0.2089	H	1	noname	0.2101
25	H10    -0.6167    -0.1767    -2.5515	H	1	noname	0.1926
26	H11     2.9114     5.0689     4.3758	H	1	noname	0.2214
@<TRIPOS>BOND
1	1	9	1
2	1	15	1
3	2	10	1
4	2	15	1
5	11	3	1
6	3	22	1
7	12	4	1
8	4	23	1
9	5	13	1
10	5	24	1
11	6	15	1
12	6	25	1
13	7	14	1
14	7	26	1
15	8	14	2
16	9	10	1
17	9	11	1
18	9	16	1
19	10	13	1
20	10	17	1
21	11	12	1
22	11	18	1
23	12	14	1
24	12	19	1
25	13	20	1
26	13	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1