@<TRIPOS>MOLECULE
DB01931
21 22 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.2868    -1.5152    -0.0000	Cl	1	noname	-0.0728
2	C1     1.4412    -0.0555    -0.0000	C.2	1	noname	0.0315
3	C2     0.0236    -0.0212     0.0000	C.2	1	noname	0.0361
4	C3     2.1197     1.1971     0.0000	C.2	1	noname	0.0127
5	C4    -0.6916    -1.2403     0.0000	C.2	1	noname	0.0488
6	C5    -0.7059     1.2268     0.0000	C.2	1	noname	0.0652
7	C6     1.4011     2.4410     0.0000	C.2	1	noname	0.0154
8	O1    -0.0294    -2.4168     0.0000	O.3	1	noname	-0.2778
9	C7    -2.1076    -1.2191    -0.0000	C.2	1	noname	0.0467
10	N1    -2.0696     1.2074    -0.0000	N.2	1	noname	-0.2098
11	C8    -0.0246     2.4780     0.0000	C.2	1	noname	0.0260
12	Cl2     2.2633     3.8911    -0.0000	Cl	1	noname	-0.0791
13	C9    -2.7770     0.0352    -0.0000	C.2	1	noname	0.0629
14	C10    -4.1665     0.0718    -0.0000	C.2	1	noname	0.1145
15	O2    -4.7628     1.1705    -0.0000	O.2	1	noname	-0.2481
16	O3    -4.8721    -1.0791    -0.0000	O.3	1	noname	-0.2109
17	H1     3.2097     1.2039     0.0000	H	1	noname	0.0654
18	H2     0.1275    -2.6956     0.9051	H	1	noname	0.2182
19	H3    -2.6722    -2.1515    -0.0000	H	1	noname	0.0675
20	H4    -0.5699     3.4217     0.0000	H	1	noname	0.0661
21	H5    -5.0394    -1.3519     0.9051	H	1	noname	0.2217
@<TRIPOS>BOND
1	1	2	1
2	2	3	1
3	2	4	2
4	3	5	2
5	3	6	1
6	4	7	1
7	5	8	1
8	5	9	1
9	6	10	2
10	6	11	1
11	7	12	1
12	7	11	2
13	9	13	2
14	10	13	1
15	13	14	1
16	14	15	2
17	14	16	1
18	4	17	1
19	8	18	1
20	9	19	1
21	11	20	1
22	16	21	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
