@<TRIPOS>MOLECULE
121225697
16 16 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.2202     0.1849     1.8715	O.3	1	noname	-0.3128
2	O2    -2.4575     0.5486     0.2500	O.2	1	noname	-0.2748
3	N1    -0.0531     0.3259     0.6084	N.3	1	noname	0.0237
4	N2    -0.3978     3.0789    -0.4357	N.3	1	noname	-0.3202
5	C1    -0.7500     1.8109    -1.0726	C.3	1	noname	0.0825
6	C2     0.5184     1.1243    -1.5759	C.3	1	noname	-0.0137
7	C3     0.7796     0.0126    -0.5536	C.3	1	noname	0.0342
8	C4    -1.2710     0.8380    -0.0165	C.2	1	noname	0.0959
9	H1    -1.4718     2.0165    -1.8631	H	1	noname	0.0561
10	H2     0.3283     0.6815    -2.5536	H	1	noname	0.0301
11	H3     1.3246     1.8564    -1.6245	H	1	noname	0.0301
12	H4     0.4729    -0.9457    -0.9726	H	1	noname	0.0461
13	H5     1.8299    -0.1141    -0.2910	H	1	noname	0.0461
14	H6    -1.2464     3.5382    -0.0990	H	1	noname	0.1191
15	H7     0.0699     3.6828    -1.1147	H	1	noname	0.1191
16	H8     0.6382     1.0046     2.2088	H	1	noname	0.2383
@<TRIPOS>BOND
1	1	3	1
2	1	16	1
3	2	8	2
4	3	7	1
5	3	8	1
6	4	5	1
7	4	14	1
8	4	15	1
9	5	6	1
10	5	8	1
11	5	9	1
12	6	7	1
13	6	10	1
14	6	11	1
15	7	12	1
16	7	13	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1