@<TRIPOS>MOLECULE
DB04189
35 34 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.1682    -0.9455     1.5239	O.2	1	noname	-0.2496
2	C1     2.1004    -0.9870     0.2764	C.2	1	noname	0.1438
3	O2     3.0240    -1.6756    -0.4273	O.3	1	noname	-0.2139
4	C2     1.0223    -0.2907    -0.4196	C.3	1	noname	0.0938
5	N1     1.5909     0.7057    -1.3258	N.3	1	noname	-0.3048
6	C3     0.1986    -1.2995    -1.2226	C.3	1	noname	-0.0269
7	C4     2.3779     1.6696    -0.5585	C.3	1	noname	0.0053
8	C5    -0.9312    -0.5698    -1.9520	C.3	1	noname	-0.0382
9	C6     2.9729     2.7123    -1.5069	C.3	1	noname	0.0460
10	C7    -1.7549    -1.5786    -2.7551	C.3	1	noname	0.0024
11	C8     3.7589     3.6749    -0.7406	C.2	1	noname	0.1354
12	N2    -2.7961    -0.9061    -3.4272	N.3	1	noname	-0.1252
13	O3     4.3359     4.6171    -1.3252	O.2	1	noname	-0.2555
14	O4     3.8626     3.5473     0.5994	O.3	1	noname	-0.2186
15	C9    -3.5014    -1.7698    -4.1148	C.2	1	noname	-0.1456
16	N3    -4.4992    -1.3742    -4.8028	N.2	1	noname	-0.2746
17	N4    -3.1813    -3.0400    -4.0955	N.3	1	noname	-0.1344
18	H1     3.6212    -2.1209     0.1783	H	1	noname	0.2213
19	H2     0.4183     0.2292     0.3240	H	1	noname	0.0573
20	H3     1.4601     0.7251    -2.3272	H	1	noname	0.1230
21	H4     0.8584    -1.7046    -1.9899	H	1	noname	0.0288
22	H5    -0.2723    -1.9669    -0.5009	H	1	noname	0.0288
23	H6     1.6711     2.1832     0.0932	H	1	noname	0.0433
24	H7     3.2058     1.1062    -0.1280	H	1	noname	0.0433
25	H8    -1.5910    -0.1647    -1.1847	H	1	noname	0.0280
26	H9    -0.4604     0.0976    -2.6738	H	1	noname	0.0280
27	H10     3.6801     2.1991    -2.1586	H	1	noname	0.0385
28	H11     2.1453     3.2761    -1.9373	H	1	noname	0.0385
29	H12    -1.1199    -1.9863    -3.5416	H	1	noname	0.0432
30	H13    -2.2505    -2.2486    -2.0525	H	1	noname	0.0432
31	H14    -3.0119     0.0805    -3.4173	H	1	noname	0.1306
32	H15     3.8805     2.6160     0.8317	H	1	noname	0.2213
33	H16    -5.2404    -1.0804    -4.1828	H	1	noname	0.1898
34	H17    -3.9061    -3.7433    -4.0881	H	1	noname	0.1267
35	H18    -2.2098    -3.3159    -4.0881	H	1	noname	0.1267
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	4	5	1
5	4	6	1
6	5	7	1
7	6	8	1
8	7	9	1
9	8	10	1
10	9	11	1
11	10	12	1
12	11	13	2
13	11	14	1
14	12	15	1
15	15	16	2
16	15	17	1
17	3	18	1
18	4	19	1
19	5	20	1
20	6	21	1
21	6	22	1
22	7	23	1
23	7	24	1
24	8	25	1
25	8	26	1
26	9	27	1
27	9	28	1
28	10	29	1
29	10	30	1
30	12	31	1
31	14	32	1
32	16	33	1
33	17	34	1
34	17	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1