@<TRIPOS>MOLECULE
DB03730
22 23 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -0.9015    -1.0258     0.0195	N.2	1	noname	-0.0978
2	C1    -0.0036     0.0060     0.0070	C.2	1	noname	0.0992
3	C2    -2.2426    -0.7455     0.1085	C.2	1	noname	0.1517
4	C3    -0.4552    -2.3610    -0.0581	C.3	1	noname	0.1700
5	N2     1.3438    -0.0122    -0.0099	N.3	1	noname	0.0712
6	C4    -0.3991     1.3471     0.0647	C.2	1	noname	0.0995
7	N3    -2.6399     0.5740     0.2094	N.2	1	noname	-0.2056
8	C5     1.7447     1.2754    -0.0137	C.2	1	noname	0.0167
9	C6     2.1717    -1.1535    -0.0214	C.3	1	noname	-0.0249
10	N4     0.6896     2.1205     0.0042	N.2	1	noname	-0.1861
11	C7    -1.7771     1.6402     0.1858	C.2	1	noname	0.0750
12	N5    -2.2199     2.9019     0.2736	N.3	1	noname	-0.1044
13	H1    -2.9755    -1.5523     0.0994	H	1	noname	0.1507
14	H2    -0.3223    -2.7588     0.9480	H	1	noname	0.0879
15	H3    -1.1933    -2.9604    -0.5912	H	1	noname	0.0879
16	H4     0.4949    -2.3962    -0.5912	H	1	noname	0.0879
17	H5     2.7875     1.5923    -0.0291	H	1	noname	0.1017
18	H6     2.3900    -1.4543     1.0033	H	1	noname	0.0438
19	H7     1.6623    -1.9668    -0.5381	H	1	noname	0.0438
20	H8     3.1030    -0.9216    -0.5381	H	1	noname	0.0438
21	H9    -1.5615     3.6670     0.3066	H	1	noname	0.1258
22	H10    -3.2122     3.0877     0.3066	H	1	noname	0.1258
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	2	5	1
5	2	6	1
6	3	7	2
7	5	8	1
8	5	9	1
9	6	10	1
10	6	11	2
11	7	11	1
12	8	10	2
13	11	12	1
14	3	13	1
15	4	14	1
16	4	15	1
17	4	16	1
18	8	17	1
19	9	18	1
20	9	19	1
21	9	20	1
22	12	21	1
23	12	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1