@<TRIPOS>MOLECULE
63177-57-1
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	C1     1.5953     0.0690    -0.2124	C.3	1	noname	0.0456
2	O1     0.2944    -0.2092     0.3163	O.3	1	noname	-0.2119
3	C2    -0.4047     0.5409     1.2236	C.2	1	noname	0.0948
4	O2     0.1176     1.5702     1.7151	O.2	1	noname	-0.2611
5	C3    -1.6902     0.1950     1.6142	C.2	1	noname	0.0624
6	C4    -2.3545    -0.8918     1.1708	C.2	1	noname	0.0044
7	C5    -3.6516    -1.2989     1.5382	C.2	1	noname	-0.0076
8	C6    -4.3316    -0.7956     2.6825	C.2	1	noname	-0.0139
9	C7    -5.6303    -1.2264     3.0221	C.2	1	noname	-0.0124
10	O3    -6.2749    -0.7275     4.1082	O.3	1	noname	-0.2878
11	C8    -6.2745    -2.1892     2.2290	C.2	1	noname	-0.0245
12	C9    -5.6255    -2.7153     1.1015	C.2	1	noname	-0.0206
13	C10    -4.3314    -2.2792     0.7596	C.2	1	noname	-0.0065
14	O4    -3.7746    -2.8440    -0.3436	O.3	1	noname	-0.2857
15	H1     2.2966     0.2190     0.6084	H	1	noname	0.0536
16	H2     1.9260    -0.7703    -0.8241	H	1	noname	0.0536
17	H3     1.5537     0.9702    -0.8241	H	1	noname	0.0536
18	H4    -2.2205     0.8275     2.3261	H	1	noname	0.0686
19	H5    -1.7950    -1.4928     0.4540	H	1	noname	0.0632
20	H6    -3.8428    -0.0576     3.3184	H	1	noname	0.0657
21	H7    -6.5965    -1.4517     4.6501	H	1	noname	0.2181
22	H8    -7.2776    -2.5279     2.4883	H	1	noname	0.0650
23	H9    -6.1279    -3.4647     0.4898	H	1	noname	0.0651
24	H10    -3.8130    -3.8002    -0.2676	H	1	noname	0.2182
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	3	4	2
4	3	5	1
5	5	6	2
6	6	7	1
7	7	8	ar
8	8	9	ar
9	9	10	1
10	9	11	ar
11	11	12	ar
12	12	13	ar
13	7	13	ar
14	13	14	1
15	1	15	1
16	1	16	1
17	1	17	1
18	5	18	1
19	6	19	1
20	8	20	1
21	10	21	1
22	11	22	1
23	12	23	1
24	14	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1