@<TRIPOS>MOLECULE
DB03823
36 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.8212    -0.3038     1.6356	O.3	1	noname	-0.2640
2	C1     0.5712    -0.0503     2.1638	C.2	1	noname	0.0142
3	C2     2.0542     0.1912     0.3017	C.3	1	noname	0.1156
4	C3    -0.1947     1.1096     1.8012	C.2	1	noname	-0.0107
5	C4     0.0831    -0.9562     3.1440	C.2	1	noname	-0.0160
6	C5     3.4983    -0.1613    -0.1029	C.2	1	noname	-0.0366
7	C6     1.6655     1.6952     0.0991	C.3	1	noname	0.0892
8	C7    -1.4688     1.3615     2.3823	C.2	1	noname	0.0127
9	C8     0.3239     2.0640     0.7954	C.3	1	noname	0.0431
10	C9    -1.2033    -0.7093     3.7215	C.2	1	noname	0.0081
11	C10     3.7327    -0.9629    -1.2140	C.2	1	noname	-0.0242
12	C11     4.5668     0.3224     0.6431	C.2	1	noname	-0.0242
13	O2     2.6611     2.6354     0.5048	O.3	1	noname	-0.3896
14	O3    -2.1848     2.4538     2.0406	O.3	1	noname	-0.2824
15	C12    -1.9677     0.4252     3.3372	C.2	1	noname	-0.0171
16	O4    -1.6961    -1.5646     4.6424	O.3	1	noname	-0.2838
17	C13     5.0357    -1.2809    -1.5791	C.2	1	noname	0.0333
18	C14     5.8697     0.0044     0.2780	C.2	1	noname	0.0333
19	O5     5.2634    -2.0595    -2.6582	O.3	1	noname	-0.2742
20	C15     6.1042    -0.7973    -0.8331	C.2	1	noname	0.0450
21	O6     6.9075     0.4741     1.0025	O.3	1	noname	-0.2742
22	O7     7.3696    -1.1061    -1.1877	O.3	1	noname	-0.2668
23	H1     1.3532    -0.3684    -0.3176	H	1	noname	0.0688
24	H2     0.6796    -1.8174     3.4449	H	1	noname	0.0677
25	H3     1.6301     1.8562    -0.9784	H	1	noname	0.0635
26	H4    -0.4345     2.0635     0.0125	H	1	noname	0.0345
27	H5     0.5177     2.9724     1.3658	H	1	noname	0.0345
28	H6     2.8948    -1.3422    -1.7990	H	1	noname	0.0654
29	H7     4.3829     0.9510     1.5143	H	1	noname	0.0654
30	H8     2.6972     2.6695     1.4635	H	1	noname	0.2105
31	H9    -2.4801     2.9043     2.8353	H	1	noname	0.2182
32	H10    -2.9510     0.5794     3.7814	H	1	noname	0.0677
33	H11    -1.5047    -1.2324     5.5225	H	1	noname	0.2181
34	H12     5.2096    -2.9835    -2.4032	H	1	noname	0.2183
35	H13     6.7109     0.3851     1.9379	H	1	noname	0.2183
36	H14     7.9005    -1.2357    -0.3984	H	1	noname	0.2184
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	2
4	2	5	1
5	3	6	1
6	3	7	1
7	4	8	1
8	4	9	1
9	5	10	2
10	6	11	2
11	6	12	1
12	7	13	1
13	7	9	1
14	8	14	1
15	8	15	2
16	10	16	1
17	10	15	1
18	11	17	1
19	12	18	2
20	17	19	1
21	17	20	2
22	18	21	1
23	18	20	1
24	20	22	1
25	3	23	1
26	5	24	1
27	7	25	1
28	9	26	1
29	9	27	1
30	11	28	1
31	12	29	1
32	13	30	1
33	14	31	1
34	15	32	1
35	16	33	1
36	19	34	1
37	21	35	1
38	22	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1