@<TRIPOS>MOLECULE
67583702
28 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -1.9997     0.9095     2.3019	O.3	1	noname	-0.2012
2	O2    -2.2894     2.3764     3.9862	O.2	1	noname	-0.2548
3	N1    -2.9666    -1.4543     1.0659	N.3	1	noname	-0.3254
4	N2    -0.2189     1.5831     3.6444	N.3	1	noname	-0.0484
5	C1    -1.9164    -0.6390     0.4578	C.3	1	noname	0.0325
6	C2    -0.9746    -1.5374    -0.3465	C.3	1	noname	-0.0103
7	C3     0.0742    -0.7232    -0.9537	C.2	1	noname	-0.0542
8	C4    -1.1257     0.0757     1.5555	C.3	1	noname	0.0732
9	C5     1.2596    -0.4909    -0.2659	C.2	1	noname	-0.0568
10	C6    -0.1127    -0.1804    -2.2196	C.2	1	noname	-0.0568
11	C7     2.2581     0.2843    -0.8440	C.2	1	noname	-0.0604
12	C8     0.8858     0.5948    -2.7977	C.2	1	noname	-0.0604
13	C9     2.0712     0.8271    -2.1099	C.2	1	noname	-0.0616
14	C10    -1.5199     1.6424     3.3291	C.2	1	noname	0.0431
15	H1    -2.3676     0.0998    -0.2046	H	1	noname	0.0490
16	H2    -1.5379    -2.0466    -1.1285	H	1	noname	0.0332
17	H3    -0.5234    -2.2761     0.3159	H	1	noname	0.0332
18	H4    -0.6745    -0.6630     2.2179	H	1	noname	0.0590
19	H5    -0.3427     0.6836     1.1021	H	1	noname	0.0590
20	H6    -3.4947    -1.9317     0.3326	H	1	noname	0.1187
21	H7    -3.5956    -0.8542     1.6031	H	1	noname	0.1187
22	H8     1.3967    -0.8892     0.6630	H	1	noname	0.0625
23	H9    -0.9825    -0.3508    -2.7243	H	1	noname	0.0625
24	H10     3.1279     0.4548    -0.3393	H	1	noname	0.0622
25	H11     0.7487     0.9932    -3.7267	H	1	noname	0.0622
26	H12     2.8039     1.3960    -2.5342	H	1	noname	0.0622
27	H13     0.1258     2.1097     4.3824	H	1	noname	0.1295
28	H14     0.3782     1.0135     3.1345	H	1	noname	0.1295
@<TRIPOS>BOND
1	1	8	1
2	1	14	1
3	2	14	2
4	5	3	1
5	3	20	1
6	3	21	1
7	4	14	1
8	4	27	1
9	4	28	1
10	5	6	1
11	5	8	1
12	5	15	1
13	6	7	1
14	6	16	1
15	6	17	1
16	7	9	2
17	7	10	1
18	8	18	1
19	8	19	1
20	9	11	1
21	9	22	1
22	10	12	2
23	10	23	1
24	11	13	2
25	11	24	1
26	12	13	1
27	12	25	1
28	13	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1