@<TRIPOS>MOLECULE
DB07346
27 27 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.2556    -1.2805    -0.2802	O.3	1	noname	-0.2872
2	C1     0.1665    -0.0199    -0.0454	C.2	1	noname	-0.0152
3	C2     1.5033     0.2219     0.2494	C.2	1	noname	-0.0307
4	C3    -0.7355     1.0363    -0.0984	C.2	1	noname	-0.0357
5	C4     1.9379     1.5199     0.4911	C.2	1	noname	-0.0586
6	C5     2.4507    -0.8875     0.3050	C.3	1	noname	0.0148
7	C6    -0.3009     2.3343     0.1434	C.2	1	noname	-0.0628
8	C7     1.0358     2.5761     0.4381	C.2	1	noname	-0.0701
9	C8     3.0611    -1.1069    -1.0807	C.3	1	noname	-0.0612
10	C9     1.4924     3.9394     0.6920	C.3	1	noname	0.0107
11	C10     1.9313     4.5838    -0.6244	C.3	1	noname	-0.0036
12	N1     2.3884     5.9490    -0.3702	N.3	1	noname	-0.3301
13	H1    -0.4056    -1.7286     0.5555	H	1	noname	0.2182
14	H2    -1.7837     0.8468    -0.3295	H	1	noname	0.0650
15	H3     2.9861     1.7095     0.7222	H	1	noname	0.0629
16	H4     3.2516    -0.5646     0.9702	H	1	noname	0.0314
17	H5     1.8626    -1.7720     0.5495	H	1	noname	0.0314
18	H6    -1.0082     3.1626     0.1018	H	1	noname	0.0626
19	H7     3.1467    -2.1760    -1.2749	H	1	noname	0.0234
20	H8     2.4213    -0.6505    -1.8359	H	1	noname	0.0234
21	H9     4.0503    -0.6505    -1.1184	H	1	noname	0.0234
22	H10     0.6201     4.4856     1.0512	H	1	noname	0.0329
23	H11     2.3757     3.8470     1.3239	H	1	noname	0.0329
24	H12     2.8033     4.0372    -0.9834	H	1	noname	0.0428
25	H13     1.0477     4.6758    -1.2561	H	1	noname	0.0428
26	H14     3.3758     6.1428    -0.2824	H	1	noname	0.1184
27	H15     1.7169     6.6983    -0.2824	H	1	noname	0.1184
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	5	8	2
8	6	9	1
9	7	8	1
10	8	10	1
11	10	11	1
12	11	12	1
13	1	13	1
14	4	14	1
15	5	15	1
16	6	16	1
17	6	17	1
18	7	18	1
19	9	19	1
20	9	20	1
21	9	21	1
22	10	22	1
23	10	23	1
24	11	24	1
25	11	25	1
26	12	26	1
27	12	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1