@<TRIPOS>MOLECULE
73425474
24 24 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     4.8608    -1.6487    -0.3628	O.3	1	noname	-0.2047
2	O2     2.9041    -1.1046     0.6107	O.2	1	noname	-0.2482
3	N1     3.0206    -2.0422    -2.5968	N.3	1	noname	-0.3194
4	C1     1.5336     0.8201    -0.6116	C.3	1	noname	-0.0148
5	C2     0.1831     1.2512    -0.4242	C.3	1	noname	-0.0253
6	C3     0.7405     0.4990     0.6568	C.2	1	noname	-0.0823
7	C4     1.5551    -0.4077    -1.5242	C.3	1	noname	-0.0214
8	C5     3.0001    -0.8690    -1.7247	C.3	1	noname	0.0920
9	C6     0.6428    -0.0596     1.8598	C.2	1	noname	-0.0904
10	C7     3.5849    -1.2132    -0.4320	C.2	1	noname	0.1479
11	C8     5.6375    -1.3897     0.7974	C.3	1	noname	0.0454
12	H1     2.4334     1.3537    -0.3054	H	1	noname	0.0352
13	H2    -0.4853     0.6142    -1.0035	H	1	noname	0.0318
14	H3    -0.2062     2.0985     0.1402	H	1	noname	0.0318
15	H4     0.9776    -1.2108    -1.0665	H	1	noname	0.0294
16	H5     1.1185    -0.1507    -2.4893	H	1	noname	0.0294
17	H6     3.5776    -0.0658    -2.1825	H	1	noname	0.0571
18	H7    -0.2009     0.0135     2.3725	H	1	noname	0.0537
19	H8     1.4138    -0.5486     2.2426	H	1	noname	0.0537
20	H9     3.9858    -2.3503    -2.7307	H	1	noname	0.1191
21	H10     2.4791    -2.7952    -2.1676	H	1	noname	0.1191
22	H11     6.6333    -1.8145     0.6703	H	1	noname	0.0536
23	H12     5.1573    -1.8427     1.6647	H	1	noname	0.0536
24	H13     5.7182    -0.3132     0.9478	H	1	noname	0.0536
@<TRIPOS>BOND
1	1	10	1
2	1	11	1
3	2	10	2
4	8	3	1
5	3	20	1
6	3	21	1
7	4	5	1
8	4	6	1
9	4	7	1
10	4	12	1
11	5	6	1
12	5	13	1
13	5	14	1
14	6	9	2
15	7	8	1
16	7	15	1
17	7	16	1
18	8	10	1
19	8	17	1
20	9	18	1
21	9	19	1
22	11	22	1
23	11	23	1
24	11	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1