@<TRIPOS>MOLECULE
DB03870
37 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -4.4136    -2.5014    -3.4771	O.3	1	noname	-0.3472
2	C1    -3.2419    -1.7254    -3.8661	C.3	1	noname	0.1833
3	C2    -4.4278    -3.9384    -3.6959	C.3	1	noname	0.0786
4	O2    -2.5029    -1.4955    -2.6809	O.3	1	noname	-0.3656
5	C3    -2.2375    -2.3892    -4.8401	C.3	1	noname	0.1335
6	C4    -3.0462    -4.6464    -3.7123	C.3	1	noname	0.1065
7	O3    -2.6304    -2.2331    -6.1874	O.3	1	noname	-0.3849
8	C5    -1.9547    -3.9110    -4.5673	C.3	1	noname	0.1198
9	O4    -3.2661    -5.9716    -4.1685	O.3	1	noname	-0.3878
10	O5    -0.6810    -4.0451    -3.8797	O.3	1	noname	-0.3408
11	C6     0.5230    -3.8266    -4.6781	C.3	1	noname	0.1869
12	O6     1.7210    -4.2500    -4.0243	O.3	1	noname	-0.3413
13	C7     0.8700    -2.3508    -4.9446	C.3	1	noname	0.1334
14	C8     2.7507    -3.7395    -4.8907	C.3	1	noname	0.1125
15	O7     0.0135    -1.8381    -5.9545	O.3	1	noname	-0.3849
16	C9     2.2931    -2.3986    -5.4653	C.3	1	noname	0.1134
17	C10     2.9923    -4.7281    -6.0332	C.3	1	noname	0.0722
18	O8     3.0478    -1.3494    -4.8771	O.3	1	noname	-0.3873
19	O9     3.4005    -5.9787    -5.4987	O.3	1	noname	-0.3934
20	H1    -3.6667    -0.8262    -4.3123	H	1	noname	0.0949
21	H2    -4.9682    -4.3298    -2.8341	H	1	noname	0.0595
22	H3    -4.8456    -4.0474    -4.6967	H	1	noname	0.0595
23	H4    -2.2581    -2.3366    -2.2882	H	1	noname	0.2134
24	H5    -1.3178    -1.8101    -4.7571	H	1	noname	0.0682
25	H6    -2.6480    -4.7387    -2.7018	H	1	noname	0.0653
26	H7    -2.7474    -3.0972    -6.5888	H	1	noname	0.2108
27	H8    -1.8781    -4.4077    -5.5345	H	1	noname	0.0662
28	H9    -3.3633    -6.5577    -3.4144	H	1	noname	0.2106
29	H10     0.2735    -4.4371    -5.5460	H	1	noname	0.0951
30	H11     0.7234    -1.6762    -4.1011	H	1	noname	0.0682
31	H12     3.6459    -3.6259    -4.2794	H	1	noname	0.0657
32	H13    -0.3909    -2.5666    -6.4313	H	1	noname	0.2108
33	H14     2.4272    -2.2435    -6.5358	H	1	noname	0.0658
34	H15     2.0371    -4.9188    -6.5224	H	1	noname	0.0591
35	H16     3.8411    -4.3699    -6.6158	H	1	noname	0.0591
36	H17     2.9990    -1.4173    -3.9207	H	1	noname	0.2106
37	H18     3.3868    -5.9366    -4.5397	H	1	noname	0.2101
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	2	4	1
4	2	5	1
5	3	6	1
6	5	7	1
7	5	8	1
8	6	9	1
9	6	8	1
10	8	10	1
11	11	10	1
12	11	12	1
13	11	13	1
14	12	14	1
15	13	15	1
16	13	16	1
17	14	17	1
18	14	16	1
19	16	18	1
20	17	19	1
21	2	20	1
22	3	21	1
23	3	22	1
24	4	23	1
25	5	24	1
26	6	25	1
27	7	26	1
28	8	27	1
29	9	28	1
30	11	29	1
31	13	30	1
32	14	31	1
33	15	32	1
34	16	33	1
35	17	34	1
36	17	35	1
37	18	36	1
38	19	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1