@<TRIPOS>MOLECULE
76955820
37 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     2.6515    -0.4027    -0.3478	N.3	1	noname	-0.3120
2	C1     1.2933     0.0928    -0.1300	C.3	1	noname	0.0042
3	C2     0.7617    -0.4442     1.2003	C.3	1	noname	-0.0380
4	C3    -0.6596     0.0743     1.4282	C.3	1	noname	-0.0516
5	C4    -1.1912    -0.4628     2.7585	C.3	1	noname	-0.0509
6	C5    -2.6125     0.0558     2.9864	C.3	1	noname	-0.0471
7	C6     2.6372    -1.8642    -0.3831	C.3	1	noname	0.0014
8	C7     1.3083     1.6223    -0.0932	C.3	1	noname	-0.0497
9	C8    -3.1442    -0.4813     4.3168	C.3	1	noname	-0.0628
10	C9    -2.5976     1.5853     3.0233	C.3	1	noname	-0.0628
11	C10     4.0585    -2.3827    -0.6110	C.3	1	noname	-0.0500
12	C11     1.7326    -2.3380    -1.5224	C.3	1	noname	-0.0500
13	H1     0.6489    -0.2447    -0.9417	H	1	noname	0.0461
14	H2     1.4061    -0.1066     2.0120	H	1	noname	0.0282
15	H3     0.7511    -1.5339     1.1740	H	1	noname	0.0282
16	H4    -0.6490     1.1639     1.4545	H	1	noname	0.0267
17	H5    -1.3040    -0.2633     0.6165	H	1	noname	0.0267
18	H6    -0.5468    -0.1252     3.5702	H	1	noname	0.0269
19	H7    -1.2019    -1.5524     2.7323	H	1	noname	0.0269
20	H8    -3.2570    -0.2818     2.1748	H	1	noname	0.0297
21	H9     3.2557    -0.0861     0.4132	H	1	noname	0.1227
22	H10     2.2585    -2.2468     0.5647	H	1	noname	0.0459
23	H11     0.2957     1.9917     0.0692	H	1	noname	0.0246
24	H12     1.6870     2.0049    -1.0409	H	1	noname	0.0246
25	H13     1.9527     1.9599     0.7185	H	1	noname	0.0246
26	H14    -4.1567    -0.1119     4.4791	H	1	noname	0.0233
27	H15    -3.1548    -1.5709     4.2905	H	1	noname	0.0233
28	H16    -2.4997    -0.1437     5.1285	H	1	noname	0.0233
29	H17    -3.6101     1.9547     3.1857	H	1	noname	0.0233
30	H18    -2.2188     1.9679     2.0756	H	1	noname	0.0233
31	H19    -1.9532     1.9229     3.8350	H	1	noname	0.0233
32	H20     4.0479    -3.4723    -0.6373	H	1	noname	0.0246
33	H21     4.4372    -2.0001    -1.5587	H	1	noname	0.0246
34	H22     4.7029    -2.0451     0.2007	H	1	noname	0.0246
35	H23     1.7220    -3.4277    -1.5487	H	1	noname	0.0246
36	H24     0.7201    -1.9686    -1.3600	H	1	noname	0.0246
37	H25     2.1114    -1.9554    -2.4702	H	1	noname	0.0246
@<TRIPOS>BOND
1	2	1	1
2	1	7	1
3	1	21	1
4	2	3	1
5	2	8	1
6	2	13	1
7	3	4	1
8	3	14	1
9	3	15	1
10	4	5	1
11	4	16	1
12	4	17	1
13	5	6	1
14	5	18	1
15	5	19	1
16	6	9	1
17	6	10	1
18	6	20	1
19	7	11	1
20	7	12	1
21	7	22	1
22	8	23	1
23	8	24	1
24	8	25	1
25	9	26	1
26	9	27	1
27	9	28	1
28	10	29	1
29	10	30	1
30	10	31	1
31	11	32	1
32	11	33	1
33	11	34	1
34	12	35	1
35	12	36	1
36	12	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1