@<TRIPOS>MOLECULE
73953237
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -2.4436     4.6789     1.5853	O.3	1	noname	-0.2219
2	O2    -1.8863    -0.1840     2.6382	O.3	1	noname	-0.2176
3	O3    -1.6565     0.4402     4.5084	O.2	1	noname	-0.2462
4	N1    -0.6784     3.8101     2.6856	N.3	1	noname	-0.0158
5	N2    -2.2697     2.3455     2.3797	N.2	1	noname	-0.1544
6	N3    -1.2069     0.5237     3.4369	N.2	1	noname	-0.1708
7	C1    -1.4226     5.7075     1.7150	C.3	1	noname	0.0832
8	C2    -0.1909     5.0986     2.4505	C.3	1	noname	-0.0277
9	C3    -1.1468     6.2443     0.2899	C.3	1	noname	-0.0274
10	C4    -1.8758     3.6064     2.1726	C.2	1	noname	0.0413
11	C5    -0.2060     2.7003     3.2634	C.2	1	noname	-0.0574
12	C6    -2.4353     6.8277    -0.2935	C.3	1	noname	-0.0628
13	C7    -1.2374     1.7691     3.0482	C.2	1	noname	0.0894
14	H1    -1.7714     6.5500     2.3323	H	1	noname	0.0626
15	H2    -0.0456     5.6113     3.4015	H	1	noname	0.0501
16	H3     0.7377     5.0490     1.8819	H	1	noname	0.0501
17	H4    -0.7973     5.4294    -0.3440	H	1	noname	0.0291
18	H5    -0.3842     7.0217     0.3358	H	1	noname	0.0291
19	H6     0.6840     2.5630     3.7425	H	1	noname	0.0844
20	H7    -2.2411     7.2058    -1.2972	H	1	noname	0.0231
21	H8    -3.1980     6.0503    -0.3393	H	1	noname	0.0231
22	H9    -2.7848     7.6426     0.3405	H	1	noname	0.0231
23	H10    -1.8634    -1.1192     2.9301	H	1	noname	0.2598
24	H11    -0.3221     0.2215     3.4457	H	1	noname	0.2795
@<TRIPOS>BOND
1	1	7	1
2	1	10	1
3	2	6	1
4	2	23	1
5	3	6	2
6	4	8	1
7	4	10	1
8	4	11	1
9	5	10	2
10	5	13	1
11	6	13	1
12	6	24	1
13	7	8	1
14	7	9	1
15	7	14	1
16	8	15	1
17	8	16	1
18	9	12	1
19	9	17	1
20	9	18	1
21	11	13	2
22	11	19	1
23	12	20	1
24	12	21	1
25	12	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1