@<TRIPOS>MOLECULE
DB01754
23 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     3.3020     1.1245    -0.3104	O.2	1	noname	-0.2597
2	C1     2.0652     1.1633    -0.1330	C.2	1	noname	0.1331
3	N1     1.3603    -0.0061     0.0193	N.3	1	noname	-0.1182
4	C2     1.4032     2.4052    -0.0905	C.2	1	noname	0.0770
5	C3    -0.0084    -0.0359     0.1618	C.2	1	noname	0.0078
6	C4     2.0679    -1.2257     0.0302	C.3	1	noname	-0.0002
7	O2     2.0989     3.5541    -0.2261	O.3	1	noname	-0.2558
8	C5    -0.0059     2.4364     0.0967	C.2	1	noname	0.0263
9	C6    -0.7391     1.2215     0.1829	C.2	1	noname	-0.0007
10	C7    -0.6945    -1.2859     0.1564	C.2	1	noname	-0.0257
11	O3    -0.6478     3.6201     0.1926	O.3	1	noname	-0.2733
12	C8    -2.1660     1.2377     0.1695	C.2	1	noname	-0.0240
13	C9    -2.1162    -1.2559     0.1090	C.2	1	noname	-0.0436
14	C10    -2.8406    -0.0139     0.1063	C.2	1	noname	-0.0521
15	H1     2.2463    -1.5331     1.0607	H	1	noname	0.0403
16	H2     1.4824    -1.9900    -0.4808	H	1	noname	0.0403
17	H3     3.0220    -1.0967    -0.4808	H	1	noname	0.0403
18	H4     2.3109     3.9042     0.6423	H	1	noname	0.2184
19	H5    -0.1517    -2.2307     0.1875	H	1	noname	0.0639
20	H6    -0.7693     3.8442     1.1182	H	1	noname	0.2183
21	H7    -2.7220     2.1745     0.2064	H	1	noname	0.0630
22	H8    -2.6595    -2.2002     0.0742	H	1	noname	0.0623
23	H9    -3.9293    -0.0215     0.0549	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	2	2
2	2	3	1
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	1
7	4	8	2
8	5	9	2
9	5	10	1
10	8	11	1
11	8	9	1
12	9	12	1
13	10	13	2
14	12	14	2
15	13	14	1
16	6	15	1
17	6	16	1
18	6	17	1
19	7	18	1
20	10	19	1
21	11	20	1
22	12	21	1
23	13	22	1
24	14	23	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
