@<TRIPOS>MOLECULE
118984421
38 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -1.1250    -7.0841     0.6820	Cl	1	noname	-0.0820
2	O1     0.7646     1.1974    -0.6623	O.3	1	noname	-0.3451
3	O2     0.5472    -2.3974    -0.1214	O.3	1	noname	-0.2685
4	O3     3.2439     1.9216     1.7139	O.2	1	noname	-0.2845
5	N1     2.1530    -0.0214     0.7016	N.3	1	noname	-0.0486
6	C1     1.2878    -0.1206    -0.5032	C.3	1	noname	0.1530
7	C2     0.0859    -1.0596    -0.2388	C.3	1	noname	0.1071
8	C3     1.9567    -0.5811    -1.8513	C.3	1	noname	-0.0071
9	C4    -0.9954    -0.9780    -1.3658	C.3	1	noname	-0.0220
10	C5     1.0031    -0.3673    -3.0601	C.3	1	noname	-0.0490
11	C6    -0.4695    -0.8490    -2.8339	C.3	1	noname	-0.0505
12	C7     1.8055     2.0952    -0.3194	C.3	1	noname	0.1305
13	C8     2.5165     1.4005     0.8411	C.2	1	noname	0.0608
14	C9     1.1003     3.3935     0.0422	C.3	1	noname	-0.0300
15	C10    -0.5010    -3.2163     0.1091	C.2	1	noname	0.0100
16	C11    -0.2953    -4.5826     0.2607	C.2	1	noname	0.0028
17	C12    -1.7859    -2.6931     0.1950	C.2	1	noname	-0.0267
18	C13    -1.3746    -5.4258     0.4981	C.2	1	noname	-0.0035
19	C14    -2.8652    -3.5363     0.4324	C.2	1	noname	-0.0419
20	C15    -2.6595    -4.9026     0.5839	C.2	1	noname	-0.0386
21	H1    -0.3965    -0.7941     0.7019	H	1	noname	0.0654
22	H2     2.2251    -1.6353    -1.7823	H	1	noname	0.0311
23	H3     2.8580    -0.0003    -2.0476	H	1	noname	0.0311
24	H4    -1.6816    -0.1585    -1.1523	H	1	noname	0.0295
25	H5    -1.6320    -1.8604    -1.3010	H	1	noname	0.0295
26	H6     1.0019     0.6862    -3.3400	H	1	noname	0.0268
27	H7     1.4148    -0.8693    -3.9356	H	1	noname	0.0268
28	H8    -1.1496    -0.2212    -3.4096	H	1	noname	0.0267
29	H9    -0.4852    -1.8683    -3.2197	H	1	noname	0.0267
30	H10     2.4250    -0.7494     1.2821	H	1	noname	0.1341
31	H11     2.5029     2.2681    -1.1446	H	1	noname	0.0699
32	H12     1.8404     4.1437     0.3208	H	1	noname	0.0262
33	H13     0.4260     3.2194     0.8807	H	1	noname	0.0262
34	H14     0.5290     3.7479    -0.8159	H	1	noname	0.0262
35	H15     0.6475    -4.9666     0.1977	H	1	noname	0.0665
36	H16    -1.9368    -1.6905     0.0838	H	1	noname	0.0650
37	H17    -3.8081    -3.1524     0.4954	H	1	noname	0.0624
38	H18    -3.4515    -5.5213     0.7581	H	1	noname	0.0638
@<TRIPOS>BOND
1	1	18	1
2	2	6	1
3	2	12	1
4	7	3	1
5	3	15	1
6	4	13	2
7	5	6	1
8	5	13	1
9	5	30	1
10	6	7	1
11	6	8	1
12	7	9	1
13	7	21	1
14	8	10	1
15	8	22	1
16	8	23	1
17	9	11	1
18	9	24	1
19	9	25	1
20	10	11	1
21	10	26	1
22	10	27	1
23	11	28	1
24	11	29	1
25	12	13	1
26	12	14	1
27	12	31	1
28	14	32	1
29	14	33	1
30	14	34	1
31	15	16	2
32	15	17	1
33	16	18	1
34	16	35	1
35	17	19	2
36	17	36	1
37	18	20	2
38	19	20	1
39	19	37	1
40	20	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1