@<TRIPOS>MOLECULE
25919
36 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     1.3966     0.2348    -0.1354	N.2	1	noname	-0.2182
2	C1     2.1019     1.4171    -0.1818	C.2	1	noname	0.0650
3	C2     0.0304     0.0957    -0.0609	C.2	1	noname	0.0326
4	N2     3.4387     1.4742    -0.2541	N.3	1	noname	-0.0917
5	C3     1.2703     2.5733    -0.1452	C.2	1	noname	-0.0413
6	C4    -0.7863     1.2602    -0.0252	C.2	1	noname	-0.0570
7	C5    -0.5288    -1.1531     0.1835	C.2	1	noname	-0.0077
8	C6     3.9980     0.8383     0.8733	C.3	1	noname	0.0139
9	N3     1.6111     3.8731    -0.1727	N.2	1	noname	-0.2214
10	N4    -0.0945     2.4563    -0.0709	N.3	1	noname	0.0001
11	C7    -2.0461     1.2079     0.5598	C.2	1	noname	-0.0313
12	C8    -1.8859    -1.2643     0.4628	C.2	1	noname	-0.0446
13	C9     5.5244     0.9035     0.7907	C.3	1	noname	0.0054
14	C10     0.4710     4.5905    -0.1165	C.2	1	noname	0.0064
15	C11    -0.6089     3.7022    -0.0521	C.2	1	noname	-0.0479
16	C12    -2.6398    -0.0735     0.7277	C.2	1	noname	-0.0447
17	N5     6.1043     0.2441     1.9596	N.3	1	noname	-0.3291
18	C13    -2.0231     4.0574     0.0215	C.3	1	noname	0.0199
19	C14    -4.0264    -0.1774     1.1728	C.3	1	noname	-0.0008
20	H1     3.9331     1.9147    -1.0168	H	1	noname	0.1297
21	H2     0.0969    -2.0452     0.1561	H	1	noname	0.0646
22	H3     3.6783     1.4336     1.7285	H	1	noname	0.0445
23	H4     3.6977    -0.2065     0.7937	H	1	noname	0.0445
24	H5    -2.5438     2.1262     0.8714	H	1	noname	0.0646
25	H6    -2.3441    -2.2533     0.4738	H	1	noname	0.0626
26	H7     5.8326     0.3118    -0.0714	H	1	noname	0.0438
27	H8     5.8131     1.9520     0.8634	H	1	noname	0.0438
28	H9     0.4302     5.6797    -0.1220	H	1	noname	0.0856
29	H10     7.0882     0.0163     1.9747	H	1	noname	0.1184
30	H11     5.5210     0.0163     2.7521	H	1	noname	0.1184
31	H12    -2.3248     4.1332     1.0662	H	1	noname	0.0293
32	H13    -2.1833     5.0152    -0.4734	H	1	noname	0.0293
33	H14    -2.6169     3.2889    -0.4734	H	1	noname	0.0293
34	H15    -4.0591    -0.1798     2.2623	H	1	noname	0.0279
35	H16    -4.5942     0.6726     0.7941	H	1	noname	0.0279
36	H17    -4.4612    -1.1024     0.7941	H	1	noname	0.0279
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	2
6	3	7	1
7	4	8	1
8	5	9	2
9	5	10	1
10	6	11	1
11	6	10	1
12	7	12	2
13	8	13	1
14	9	14	1
15	10	15	1
16	11	16	2
17	12	16	1
18	13	17	1
19	14	15	2
20	15	18	1
21	16	19	1
22	4	20	1
23	7	21	1
24	8	22	1
25	8	23	1
26	11	24	1
27	12	25	1
28	13	26	1
29	13	27	1
30	14	28	1
31	17	29	1
32	17	30	1
33	18	31	1
34	18	32	1
35	18	33	1
36	19	34	1
37	19	35	1
38	19	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1