@<TRIPOS>MOLECULE
67532809
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.2054    -1.0105    -2.6386	O.3	1	noname	-0.2139
2	O2     3.1661     0.5387    -1.3159	O.2	1	noname	-0.2495
3	N1     1.4839     0.1085     1.6948	N.3	1	noname	-0.0483
4	N2     3.7434    -2.7199    -0.8374	N.3	1	noname	-0.3191
5	N3     2.0720     2.1969     1.7923	N.2	1	noname	-0.2418
6	C1     3.5762    -0.9284     0.8155	C.3	1	noname	0.0118
7	C2     2.9133    -1.6041    -0.3865	C.3	1	noname	0.0966
8	C3     2.7472     0.1859     1.2658	C.2	1	noname	-0.0675
9	C4     3.1269     1.5198     1.3266	C.2	1	noname	0.0121
10	C5     2.7686    -0.6363    -1.4701	C.2	1	noname	0.1439
11	C6     1.0682     1.3402     2.0180	C.2	1	noname	-0.0518
12	H1     3.6842    -1.6509     1.6245	H	1	noname	0.0351
13	H2     4.5592    -0.5565     0.5269	H	1	noname	0.0351
14	H3     1.9302    -1.9760    -0.0979	H	1	noname	0.0575
15	H4     0.9567    -0.7030     1.7609	H	1	noname	0.1534
16	H5     4.0338     1.9077     1.0668	H	1	noname	0.0856
17	H6     3.8447    -3.3973    -0.0789	H	1	noname	0.1192
18	H7     3.3007    -3.1712    -1.6404	H	1	noname	0.1192
19	H8     0.1444     1.5839     2.3752	H	1	noname	0.1013
20	H9     1.7119    -0.3565    -3.1763	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	10	1
2	1	20	1
3	2	10	2
4	3	8	1
5	3	11	1
6	3	15	1
7	7	4	1
8	4	17	1
9	4	18	1
10	5	9	1
11	5	11	2
12	6	7	1
13	6	8	1
14	6	12	1
15	6	13	1
16	7	10	1
17	7	14	1
18	8	9	2
19	9	16	1
20	11	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1