@<TRIPOS>MOLECULE
DB01291
37 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.4166    -1.3443     0.2641	O.3	1	noname	-0.2749
2	C1     0.0615    -0.0939     0.0895	C.2	1	noname	0.0452
3	C2     1.4619     0.1873     0.2292	C.2	1	noname	0.0442
4	C3    -0.8166     0.9934    -0.2415	C.2	1	noname	-0.0049
5	N1     1.9066     1.4871     0.0404	N.2	1	noname	-0.2210
6	C4     2.4028    -0.8776     0.5645	C.3	1	noname	0.0880
7	C5    -0.3312     2.3305    -0.4318	C.2	1	noname	-0.0035
8	C6     1.0752     2.5558    -0.2805	C.2	1	noname	0.0053
9	O2     3.3678    -0.9996    -0.4700	O.3	1	noname	-0.3898
10	C7     1.6310     3.8937    -0.4612	C.3	1	noname	0.1084
11	O3     2.2674     4.3079     0.7387	O.3	1	noname	-0.3853
12	C8     2.6532     3.8718    -1.5994	C.3	1	noname	0.0276
13	N2     3.2098     5.2116    -1.7804	N.3	1	noname	-0.3090
14	C9     4.1866     5.1907    -2.8680	C.3	1	noname	0.0099
15	C10     4.7690     6.5928    -3.0574	C.3	1	noname	-0.0474
16	C11     5.3121     4.2131    -2.5239	C.3	1	noname	-0.0474
17	C12     3.5008     4.7444    -4.1608	C.3	1	noname	-0.0474
18	H1    -0.4882    -1.5313     1.2030	H	1	noname	0.2182
19	H2    -1.8832     0.7978    -0.3515	H	1	noname	0.0651
20	H3     2.9466    -0.5602     1.4542	H	1	noname	0.0632
21	H4     1.8431    -1.8129     0.5725	H	1	noname	0.0632
22	H5    -1.0078     3.1474    -0.6828	H	1	noname	0.0643
23	H6     3.5322    -1.9289    -0.6463	H	1	noname	0.2105
24	H7     0.8148     4.5935    -0.6407	H	1	noname	0.0681
25	H8     2.5345     3.5355     1.2423	H	1	noname	0.2110
26	H9     3.4843     3.2417    -1.2828	H	1	noname	0.0459
27	H10     2.1157     3.6432    -2.5197	H	1	noname	0.0459
28	H11     2.9583     6.0256    -1.2380	H	1	noname	0.1228
29	H12     4.9561     7.0432    -2.0826	H	1	noname	0.0249
30	H13     5.7048     6.5255    -3.6122	H	1	noname	0.0249
31	H14     4.0611     7.2084    -3.6122	H	1	noname	0.0249
32	H15     5.4049     4.1325    -1.4409	H	1	noname	0.0249
33	H16     5.0830     3.2332    -2.9429	H	1	noname	0.0249
34	H17     6.2502     4.5770    -2.9429	H	1	noname	0.0249
35	H18     3.4785     3.6554    -4.2030	H	1	noname	0.0249
36	H19     2.4815     5.1299    -4.1833	H	1	noname	0.0249
37	H20     4.0540     5.1299    -5.0173	H	1	noname	0.0249
@<TRIPOS>BOND
1	1	2	1
2	2	3	2
3	2	4	1
4	3	5	1
5	3	6	1
6	4	7	2
7	5	8	2
8	6	9	1
9	7	8	1
10	8	10	1
11	10	11	1
12	10	12	1
13	12	13	1
14	13	14	1
15	14	15	1
16	14	16	1
17	14	17	1
18	1	18	1
19	4	19	1
20	6	20	1
21	6	21	1
22	7	22	1
23	9	23	1
24	10	24	1
25	11	25	1
26	12	26	1
27	12	27	1
28	13	28	1
29	15	29	1
30	15	30	1
31	15	31	1
32	16	32	1
33	16	33	1
34	16	34	1
35	17	35	1
36	17	36	1
37	17	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1