@<TRIPOS>MOLECULE
92283029
39 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.0209    -2.5641    -2.3759	O.3	1	noname	-0.3815
2	C1    -0.5049     0.1428     0.1717	C.3	1	noname	-0.0421
3	C2     0.3225     1.2204    -0.5318	C.3	1	noname	-0.0506
4	C3     0.7241     2.2963     0.4792	C.3	1	noname	-0.0528
5	C4     1.5514     3.3740    -0.2244	C.3	1	noname	-0.0509
6	C5    -0.9064    -0.9331    -0.8393	C.3	1	noname	-0.0270
7	C6     1.9530     4.4499     0.7866	C.3	1	noname	-0.0471
8	C7    -1.7630     0.7753     0.7701	C.3	1	noname	-0.0624
9	C8     0.3517    -1.5656    -1.4376	C.3	1	noname	0.0469
10	C9     2.7804     5.5275     0.0830	C.3	1	noname	-0.0628
11	C10     0.6949     5.0824     1.3850	C.3	1	noname	-0.0628
12	C11     1.1467    -3.1512    -2.9313	C.3	1	noname	0.0438
13	C12     0.7452    -4.2271    -3.9423	C.3	1	noname	-0.0416
14	H1     0.0880    -0.3091     0.9670	H	1	noname	0.0300
15	H2    -0.2704     1.6723    -1.3271	H	1	noname	0.0269
16	H3     1.2188     0.7698    -0.9581	H	1	noname	0.0269
17	H4    -0.1722     2.7469     0.9055	H	1	noname	0.0267
18	H5     1.3169     1.8445     1.2744	H	1	noname	0.0267
19	H6     0.9585     3.8258    -1.0196	H	1	noname	0.0269
20	H7     2.4477     2.9233    -0.6507	H	1	noname	0.0269
21	H8    -1.4958    -1.7008    -0.3380	H	1	noname	0.0293
22	H9    -1.4993    -0.4812    -1.6345	H	1	noname	0.0293
23	H10     2.5459     3.9980     1.5819	H	1	noname	0.0297
24	H11    -2.3524     0.0076     1.2713	H	1	noname	0.0233
25	H12    -2.3559     1.2272    -0.0251	H	1	noname	0.0233
26	H13    -1.4769     1.5418     1.4904	H	1	noname	0.0233
27	H14     0.9446    -2.0175    -0.6424	H	1	noname	0.0566
28	H15     0.9412    -0.7979    -1.9389	H	1	noname	0.0566
29	H16     3.0664     6.2940     0.8033	H	1	noname	0.0233
30	H17     2.1875     5.9793    -0.7122	H	1	noname	0.0233
31	H18     3.6766     5.0769    -0.3432	H	1	noname	0.0233
32	H19     0.9809     5.8488     2.1052	H	1	noname	0.0233
33	H20     0.1054     4.3146     1.8862	H	1	noname	0.0233
34	H21     0.1020     5.5342     0.5897	H	1	noname	0.0233
35	H22     1.7396    -3.6030    -2.1360	H	1	noname	0.0563
36	H23     1.7362    -2.3834    -3.4325	H	1	noname	0.0563
37	H24     1.6415    -4.6777    -4.3686	H	1	noname	0.0254
38	H25     0.1557    -4.9948    -3.4410	H	1	noname	0.0254
39	H26     0.1523    -3.7752    -4.7375	H	1	noname	0.0254
@<TRIPOS>BOND
1	1	9	1
2	1	12	1
3	2	3	1
4	2	6	1
5	2	8	1
6	2	14	1
7	3	4	1
8	3	15	1
9	3	16	1
10	4	5	1
11	4	17	1
12	4	18	1
13	5	7	1
14	5	19	1
15	5	20	1
16	6	9	1
17	6	21	1
18	6	22	1
19	7	10	1
20	7	11	1
21	7	23	1
22	8	24	1
23	8	25	1
24	8	26	1
25	9	27	1
26	9	28	1
27	10	29	1
28	10	30	1
29	10	31	1
30	11	32	1
31	11	33	1
32	11	34	1
33	12	13	1
34	12	35	1
35	12	36	1
36	13	37	1
37	13	38	1
38	13	39	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1