@<TRIPOS>MOLECULE
71586857
18 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.2609    -0.6405    -0.0294	O.3	1	noname	-0.2757
2	O2    -0.3564    -2.2840     0.5741	O.3	1	noname	-0.2177
3	O3     1.5785    -2.4791    -0.5620	O.2	1	noname	-0.2577
4	N1     1.4216     3.7250    -0.0191	N.3	1	noname	-0.1500
5	C1     0.9043    -0.3624    -0.0169	C.2	1	noname	-0.0155
6	C2     1.2534     2.3956    -0.0184	C.2	1	noname	-0.0031
7	C3     2.1858     0.1759    -0.0236	C.2	1	noname	0.0442
8	C4    -0.2027     0.4782    -0.0109	C.2	1	noname	-0.0014
9	C5     2.3603     1.5549    -0.0244	C.2	1	noname	-0.0268
10	C6    -0.0281     1.8572    -0.0116	C.2	1	noname	-0.0648
11	C7     0.7298    -1.7414    -0.0161	C.2	1	noname	0.0866
12	H1    -1.1430     0.0832    -0.0060	H	1	noname	0.0632
13	H2     3.3007     1.9500    -0.0293	H	1	noname	0.0666
14	H3    -0.8404     2.4741    -0.0072	H	1	noname	0.0639
15	H4     2.3695     3.9309    -0.0241	H	1	noname	0.1242
16	H5     1.0044     4.1033    -0.8088	H	1	noname	0.1242
17	H6    -0.7282    -3.1257     0.2369	H	1	noname	0.2216
18	H7     4.0798    -0.1023    -0.0337	H	1	noname	0.2182
@<TRIPOS>BOND
1	1	7	1
2	1	18	1
3	2	11	1
4	2	17	1
5	3	11	2
6	4	6	1
7	4	15	1
8	4	16	1
9	5	7	2
10	5	8	1
11	5	11	1
12	6	9	2
13	6	10	1
14	7	9	1
15	8	10	2
16	8	12	1
17	9	13	1
18	10	14	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1