@<TRIPOS>MOLECULE
69567153
35 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	Cl1    -3.2443    -4.2705     2.4114	Cl	1	noname	-0.0832
2	N1     0.1766    -0.0277     0.0951	N.3	1	noname	0.0036
3	N2     0.6342     2.0157    -0.5862	N.2	1	noname	-0.1606
4	N3     1.7548     1.3993    -0.4994	N.2	1	noname	-0.1761
5	N4    -2.0653     2.6104    -0.8035	N.3	1	noname	-0.1310
6	C1    -0.6411    -1.0203     0.5968	C.2	1	noname	-0.0618
7	C2    -2.0833    -0.8471     0.5759	C.2	1	noname	-0.0061
8	C3    -2.6379     0.3902     0.0565	C.2	1	noname	0.0156
9	C4    -0.3428     1.1529    -0.2916	C.2	1	noname	-0.0220
10	C5    -1.7153     1.3988    -0.3418	C.2	1	noname	0.0448
11	C6     1.5181     0.1313    -0.1456	C.2	1	noname	0.0052
12	C7    -4.0807     0.6835     0.0238	C.2	1	noname	-0.0384
13	C8    -0.0874    -2.1456     1.2537	C.2	1	noname	-0.0243
14	C9    -2.8598    -1.9109     1.1405	C.2	1	noname	-0.0007
15	C10    -0.8900    -3.0714     1.9281	C.2	1	noname	-0.0134
16	C11    -2.2829    -3.0104     1.7935	C.2	1	noname	-0.0037
17	C12     2.6428    -0.7960    -0.1279	C.3	1	noname	0.0545
18	C13    -4.6349     1.9099     0.5289	C.2	1	noname	-0.0413
19	C14    -5.0372    -0.2927    -0.4172	C.2	1	noname	-0.0413
20	C15    -6.0318     2.0972     0.6961	C.2	1	noname	-0.0559
21	C16    -6.4329    -0.1256    -0.2507	C.2	1	noname	-0.0559
22	C17    -6.9235     1.0658     0.3285	C.2	1	noname	-0.0547
23	H1     0.9000    -2.3101     1.2963	H	1	noname	0.0643
24	H2    -3.8727    -1.9023     1.1365	H	1	noname	0.0645
25	H3    -0.4785    -3.7980     2.5296	H	1	noname	0.0638
26	H4     2.4720    -1.5884    -0.8566	H	1	noname	0.0310
27	H5     2.7390    -1.2315     0.8667	H	1	noname	0.0310
28	H6     3.5585    -0.2613    -0.3805	H	1	noname	0.0310
29	H7    -1.2667     3.1212    -1.0090	H	1	noname	0.1244
30	H8    -2.5995     2.5084    -1.6068	H	1	noname	0.1244
31	H9    -4.0458     2.6799     0.8186	H	1	noname	0.0629
32	H10    -4.7383    -1.1647    -0.8271	H	1	noname	0.0629
33	H11    -6.3896     2.9720     1.0796	H	1	noname	0.0622
34	H12    -7.0782    -0.8582    -0.5461	H	1	noname	0.0622
35	H13    -7.9252     1.1814     0.4818	H	1	noname	0.0622
@<TRIPOS>BOND
1	1	16	1
2	2	6	1
3	2	9	1
4	2	11	1
5	3	4	1
6	3	9	2
7	4	11	2
8	5	10	1
9	5	29	1
10	5	30	1
11	6	7	2
12	6	13	1
13	7	8	1
14	7	14	1
15	8	10	2
16	8	12	1
17	9	10	1
18	11	17	1
19	12	18	2
20	12	19	1
21	13	15	2
22	13	23	1
23	14	16	2
24	14	24	1
25	15	16	1
26	15	25	1
27	17	26	1
28	17	27	1
29	17	28	1
30	18	20	1
31	18	31	1
32	19	21	2
33	19	32	1
34	20	22	2
35	20	33	1
36	21	22	1
37	21	34	1
38	22	35	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1