@<TRIPOS>MOLECULE
71367300
28 29 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     2.6138    -2.0955     2.8690	O.3	1	noname	-0.2139
2	O2     0.7898    -1.6146     1.6385	O.2	1	noname	-0.2495
3	O3     1.1079     4.3757     0.2155	O.2	1	noname	-0.1459
4	N1     0.3121     2.4528     0.4678	N.3	1	noname	-0.1393
5	N2     3.7367    -2.2105     0.1749	N.3	1	noname	-0.3191
6	N3     0.2305     3.7003     0.5777	N.2	1	noname	-0.0166
7	C1     1.0970     0.4066    -0.0306	C.2	1	noname	-0.0008
8	C2     1.9677    -0.6667    -0.5011	C.3	1	noname	-0.0010
9	C3    -0.1641     0.2795     0.5303	C.2	1	noname	-0.0071
10	C4    -0.6265     1.5735     0.8462	C.2	1	noname	-0.0004
11	C5     2.8647    -1.1358     0.6461	C.3	1	noname	0.0954
12	C6     1.3586     1.7776    -0.0504	C.2	1	noname	0.0038
13	C7    -0.9206    -0.8849     0.8361	C.2	1	noname	-0.0363
14	C8    -1.8607     1.7863     1.5231	C.2	1	noname	-0.0193
15	C9    -2.1837    -0.6926     1.4895	C.2	1	noname	-0.0534
16	C10     2.0354    -1.6273     1.7426	C.2	1	noname	0.1439
17	C11    -2.6421     0.6234     1.8388	C.2	1	noname	-0.0475
18	H1     1.3596    -1.5008    -0.8512	H	1	noname	0.0338
19	H2     2.5869    -0.2998    -1.3197	H	1	noname	0.0338
20	H3     3.4729    -0.3017     0.9962	H	1	noname	0.0575
21	H4     2.2142     2.2055    -0.4043	H	1	noname	0.0817
22	H5    -0.5800    -1.8172     0.6011	H	1	noname	0.0629
23	H6    -2.1762     2.7235     1.7729	H	1	noname	0.0643
24	H7    -2.7644    -1.5019     1.7091	H	1	noname	0.0622
25	H8    -3.5357     0.7335     2.3181	H	1	noname	0.0623
26	H9     4.3359    -2.5238     0.9413	H	1	noname	0.1191
27	H10     3.1665    -2.9926    -0.1533	H	1	noname	0.1191
28	H11     2.1499    -2.0141     3.7284	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	16	1
2	1	28	1
3	2	16	2
4	3	6	2
5	4	6	1
6	4	10	1
7	4	12	1
8	11	5	1
9	5	26	1
10	5	27	1
11	7	8	1
12	7	9	1
13	7	12	2
14	8	11	1
15	8	18	1
16	8	19	1
17	9	10	1
18	9	13	2
19	10	14	2
20	11	16	1
21	11	20	1
22	12	21	1
23	13	15	1
24	13	22	1
25	14	17	1
26	14	23	1
27	15	17	2
28	15	24	1
29	17	25	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1