@<TRIPOS>MOLECULE
119025905
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.1797     2.0312    -0.8898	O.3	1	noname	-0.2010
2	O2     2.9094     0.3977    -0.8542	O.3	1	noname	-0.3855
3	O3    -2.3111    -0.2001     1.7540	O.3	1	noname	-0.2759
4	O4    -1.9331     1.8448     0.2080	O.2	1	noname	-0.2546
5	C1     2.2460     1.1181     0.1805	C.3	1	noname	0.1065
6	C2     1.5185     2.3723    -0.4127	C.3	1	noname	0.0949
7	C3     1.3005     0.1793     0.8724	C.2	1	noname	0.0195
8	C4    -0.1195     0.3963     0.9017	C.2	1	noname	0.0330
9	C5     1.4922     3.5593     0.5893	C.3	1	noname	-0.0351
10	C6    -0.7474     1.4704     0.0791	C.2	1	noname	0.1021
11	C7     1.8731    -0.9621     1.5220	C.2	1	noname	-0.0428
12	C8    -0.9889    -0.4540     1.6554	C.2	1	noname	0.0507
13	C9     1.0051    -1.8404     2.2232	C.2	1	noname	-0.0250
14	C10    -0.3997    -1.5777     2.2957	C.2	1	noname	-0.0149
15	H1     3.0210     1.4324     0.8913	H	1	noname	0.0679
16	H2     2.1145     2.7318    -1.2666	H	1	noname	0.0638
17	H3     2.5077     3.7794     0.9186	H	1	noname	0.0258
18	H4     0.8803     3.2937     1.4513	H	1	noname	0.0258
19	H5     1.0702     4.4377     0.1009	H	1	noname	0.0258
20	H6     2.8768    -1.1390     1.4819	H	1	noname	0.0626
21	H7     1.3873    -2.6682     2.6804	H	1	noname	0.0623
22	H8     3.5714     0.9786    -1.2840	H	1	noname	0.2110
23	H9    -0.9959    -2.2158     2.8227	H	1	noname	0.0650
24	H10    -2.7356    -0.8887     2.3071	H	1	noname	0.2182
@<TRIPOS>BOND
1	1	6	1
2	1	10	1
3	5	2	1
4	2	22	1
5	3	12	1
6	3	24	1
7	4	10	2
8	5	6	1
9	5	7	1
10	5	15	1
11	6	9	1
12	6	16	1
13	7	8	2
14	7	11	1
15	8	10	1
16	8	12	1
17	9	17	1
18	9	18	1
19	9	19	1
20	11	13	2
21	11	20	1
22	12	14	2
23	13	14	1
24	13	21	1
25	14	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1