@<TRIPOS>MOLECULE
76959132
28 30 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     2.4794    -0.0832    -0.7694	N.3	1	noname	-0.3135
2	C1    -0.1380    -0.5240    -2.0574	C.3	1	noname	0.0150
3	C2     1.3320     0.8487    -0.5572	C.3	1	noname	0.0114
4	C3     0.0159    -0.0096    -0.5858	C.3	1	noname	-0.0304
5	C4     1.0959    -1.4008    -2.4676	C.3	1	noname	-0.0337
6	C5     1.3158     2.0361    -1.5867	C.3	1	noname	0.0153
7	C6    -0.3638     0.6686    -2.9409	C.2	1	noname	-0.0574
8	C7     2.5034    -0.8916    -2.0280	C.3	1	noname	-0.0040
9	C8     0.3825     1.8880    -2.7481	C.2	1	noname	-0.0578
10	C9    -1.3750     0.5984    -3.9631	C.2	1	noname	-0.0638
11	C10     0.1804     3.0165    -3.5998	C.2	1	noname	-0.0641
12	C11    -1.5901     1.7298    -4.7895	C.2	1	noname	-0.0688
13	C12    -0.8151     2.9177    -4.6171	C.2	1	noname	-0.0690
14	H1    -1.0175    -1.1690    -2.1435	H	1	noname	0.0353
15	H2     1.4827     1.2814     0.4396	H	1	noname	0.0468
16	H3    -0.8352     0.6218    -0.3307	H	1	noname	0.0289
17	H4     0.1202    -0.8304     0.1239	H	1	noname	0.0289
18	H5     1.0871    -1.5585    -3.5461	H	1	noname	0.0286
19	H6     0.9594    -2.3456    -1.9414	H	1	noname	0.0286
20	H7     1.0999     2.9676    -1.0635	H	1	noname	0.0332
21	H8     2.3212     2.2268    -1.9619	H	1	noname	0.0332
22	H9     2.9430    -0.3003    -2.8313	H	1	noname	0.0428
23	H10     3.1821    -1.7365    -1.9115	H	1	noname	0.0428
24	H11     3.3576     0.4314    -0.6783	H	1	noname	0.1225
25	H12    -1.9267    -0.2500    -4.0903	H	1	noname	0.0625
26	H13     0.7311     3.8673    -3.4844	H	1	noname	0.0625
27	H14    -2.3060     1.6954    -5.5153	H	1	noname	0.0622
28	H15    -0.9772     3.7128    -5.2351	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	3	1
2	1	8	1
3	1	24	1
4	2	4	1
5	2	5	1
6	2	7	1
7	2	14	1
8	3	4	1
9	3	6	1
10	3	15	1
11	4	16	1
12	4	17	1
13	5	8	1
14	5	18	1
15	5	19	1
16	6	9	1
17	6	20	1
18	6	21	1
19	7	9	1
20	7	10	2
21	8	22	1
22	8	23	1
23	9	11	2
24	10	12	1
25	10	25	1
26	11	13	1
27	11	26	1
28	12	13	2
29	12	27	1
30	13	28	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1