@<TRIPOS>MOLECULE
109374167
19 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.4730     1.9745    -1.2242	O.3	1	noname	-0.2140
2	O2    -3.5846     0.3958     0.1529	O.3	1	noname	-0.2189
3	O3     0.6518     2.1348     0.0911	O.2	1	noname	-0.2496
4	O4    -2.2436    -0.8379     1.4767	O.2	1	noname	-0.2559
5	N1     2.4550    -0.6795    -0.0043	N.3	1	noname	-0.3194
6	C1     0.0428    -0.4068     0.2726	C.3	1	noname	-0.0190
7	C2     1.2683    -0.0352    -0.5647	C.3	1	noname	0.0918
8	C3    -1.1991     0.2675    -0.3139	C.3	1	noname	0.0354
9	C4     1.4477     1.4137    -0.5485	C.2	1	noname	0.1437
10	C5    -2.3685    -0.0871     0.4851	C.2	1	noname	0.1348
11	H1    -0.0911    -1.4884     0.2605	H	1	noname	0.0293
12	H2     0.1885    -0.0702     1.2990	H	1	noname	0.0293
13	H3     1.1227    -0.3718    -1.5911	H	1	noname	0.0571
14	H4    -1.3447    -0.0691    -1.3403	H	1	noname	0.0373
15	H5    -1.0652     1.3491    -0.3018	H	1	noname	0.0373
16	H6     2.3295    -1.6936    -0.0156	H	1	noname	0.1191
17	H7     2.5915    -0.3638     0.9582	H	1	noname	0.1191
18	H8     2.3815     2.8783    -1.5919	H	1	noname	0.2213
19	H9    -4.3901    -0.1250     0.3536	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	9	1
2	1	18	1
3	2	10	1
4	2	19	1
5	3	9	2
6	4	10	2
7	7	5	1
8	5	16	1
9	5	17	1
10	6	7	1
11	6	8	1
12	6	11	1
13	6	12	1
14	7	9	1
15	7	13	1
16	8	10	1
17	8	14	1
18	8	15	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1