@<TRIPOS>MOLECULE
72941718
38 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     0.4265    -1.4351     1.7867	O.3	1	noname	0.0000
2	O2     1.1103     0.9228    -0.8314	O.3	1	noname	0.0000
3	O3     1.7002     6.1152    -3.3206	O.2	1	noname	0.0000
4	N1     2.2922    -3.2765    -0.0185	N.3	1	noname	0.0000
5	N2     1.4826     4.1296    -2.3687	N.3	1	noname	0.0000
6	C1     2.1852    -1.7518     0.0583	C.3	1	noname	0.0000
7	C2     0.8098    -1.1083     0.4584	C.3	1	noname	0.0000
8	C3     3.7026    -3.6663    -0.4255	C.3	1	noname	0.0000
9	C4     1.3222    -3.8274    -1.0436	C.3	1	noname	0.0000
10	C5     2.0303    -3.9202     1.3388	C.3	1	noname	0.0000
11	C6     0.8059     0.4325     0.4701	C.3	1	noname	0.0000
12	C7     1.1101     2.3430    -0.8633	C.3	1	noname	0.0000
13	C8     1.4824     2.7043    -2.2772	C.3	1	noname	0.0000
14	C9     1.7625     4.8720    -3.4683	C.2	1	noname	0.0000
15	C10     2.1305     4.3657    -4.8148	C.3	1	noname	0.0000
16	H1     2.4645    -1.3475    -0.9295	H	1	noname	0.0000
17	H2     2.9537    -1.3587     0.7451	H	1	noname	0.0000
18	H3     0.0425    -1.4358    -0.2419	H	1	noname	0.0000
19	H4     2.3051    -4.9777     1.3454	H	1	noname	0.0000
20	H5     0.9863    -3.8706     1.6475	H	1	noname	0.0000
21	H6     2.6214    -3.4491     2.1280	H	1	noname	0.0000
22	H7     1.4062    -4.9065    -1.1480	H	1	noname	0.0000
23	H8     0.2743    -3.6021    -0.7866	H	1	noname	0.0000
24	H9     1.4986    -3.3933    -2.0276	H	1	noname	0.0000
25	H10     3.8243    -4.7509    -0.4779	H	1	noname	0.0000
26	H11     3.9614    -3.2660    -1.4079	H	1	noname	0.0000
27	H12     4.4414    -3.2928     0.2893	H	1	noname	0.0000
28	H13    -0.2081     0.7488     0.7712	H	1	noname	0.0000
29	H14     1.5266     0.7849     1.2260	H	1	noname	0.0000
30	H15    -0.0647    -2.2722     1.7168	H	1	noname	0.0000
31	H16     0.1073     2.7112    -0.6462	H	1	noname	0.0000
32	H17     1.7841     2.7800    -0.1265	H	1	noname	0.0000
33	H18     0.7407     2.2962    -2.9638	H	1	noname	0.0000
34	H19     2.4620     2.3338    -2.5791	H	1	noname	0.0000
35	H20     1.2559     4.6254    -1.5517	H	1	noname	0.0000
36	H21     1.3239     3.7430    -5.2018	H	1	noname	0.0000
37	H22     2.2941     5.2078    -5.4873	H	1	noname	0.0000
38	H23     3.0436     3.7748    -4.7437	H	1	noname	0.0000
@<TRIPOS>BOND
1	1	7	1
2	1	30	1
3	2	11	1
4	2	12	1
5	3	14	2
6	4	6	1
7	4	8	1
8	4	9	1
9	4	10	1
10	5	13	1
11	5	14	1
12	5	35	1
13	6	7	1
14	6	16	1
15	6	17	1
16	7	11	1
17	7	18	1
18	8	25	1
19	8	26	1
20	8	27	1
21	9	22	1
22	9	23	1
23	9	24	1
24	10	19	1
25	10	20	1
26	10	21	1
27	11	28	1
28	11	29	1
29	12	13	1
30	12	31	1
31	12	32	1
32	13	33	1
33	13	34	1
34	14	15	1
35	15	36	1
36	15	37	1
37	15	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1