@<TRIPOS>MOLECULE
76963025
27 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1     2.5359    -0.4326    -2.0795	Cl	1	noname	-0.1141
2	O1    -0.7231    -0.6694    -1.5841	O.2	1	noname	-0.2905
3	C1     0.5707     2.0509     0.2395	C.3	1	noname	-0.0184
4	C2    -0.1889     1.7521    -1.0470	C.3	1	noname	0.0332
5	C3     1.8724     1.5537    -0.3648	C.3	1	noname	-0.0117
6	C4     0.5683     2.6204    -2.1016	C.3	1	noname	-0.0400
7	C5     2.0371     2.4621    -1.6199	C.3	1	noname	-0.0471
8	C6     1.5401     0.0781    -0.7251	C.3	1	noname	0.0959
9	C7     0.0630     0.2198    -1.1920	C.2	1	noname	0.1503
10	C8     0.1161     1.0857     1.3362	C.3	1	noname	-0.0586
11	C9     0.5676     3.5187     0.6715	C.3	1	noname	-0.0586
12	C10    -1.6685     2.1285    -0.8980	C.3	1	noname	-0.0521
13	H1     2.7734     1.5983     0.2470	H	1	noname	0.0328
14	H2     0.2632     3.6621    -2.0010	H	1	noname	0.0277
15	H3     0.3845     2.2304    -3.1027	H	1	noname	0.0277
16	H4     2.4268     3.4338    -1.3165	H	1	noname	0.0270
17	H5     2.6860     1.9705    -2.3448	H	1	noname	0.0270
18	H6     1.5989    -0.6111     0.1172	H	1	noname	0.0556
19	H7     0.6595     1.2995     2.2565	H	1	noname	0.0236
20	H8    -0.9531     1.2092     1.5085	H	1	noname	0.0236
21	H9     0.3179     0.0609     1.0247	H	1	noname	0.0236
22	H10     1.1340     3.6264     1.5965	H	1	noname	0.0236
23	H11    -0.4589     3.8475     0.8336	H	1	noname	0.0236
24	H12     1.0254     4.1278    -0.1080	H	1	noname	0.0236
25	H13    -2.1947     1.9079    -1.8267	H	1	noname	0.0241
26	H14    -2.1098     1.5524    -0.0847	H	1	noname	0.0241
27	H15    -1.7522     3.1925    -0.6768	H	1	noname	0.0241
@<TRIPOS>BOND
1	8	1	1
2	2	9	2
3	3	4	1
4	3	5	1
5	3	10	1
6	3	11	1
7	4	6	1
8	4	9	1
9	4	12	1
10	5	7	1
11	5	8	1
12	5	13	1
13	6	7	1
14	6	14	1
15	6	15	1
16	7	16	1
17	7	17	1
18	8	9	1
19	8	18	1
20	10	19	1
21	10	20	1
22	10	21	1
23	11	22	1
24	11	23	1
25	11	24	1
26	12	25	1
27	12	26	1
28	12	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1