@<TRIPOS>MOLECULE
DB01937
38 40 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     4.7270     0.5693     2.1648	P	1	noname	0.0169
2	O1     4.4231     1.3086     3.3626	O.2	1	noname	-0.1962
3	O2     3.4167     0.1792     1.4560	O.3	1	noname	-0.1471
4	O3     5.5105    -0.7044     2.5327	O.3	1	noname	-0.1643
5	O4     5.5789     1.4425     1.2249	O.3	1	noname	-0.1643
6	C1     3.7164    -0.5498     0.2749	C.3	1	noname	0.1449
7	C2     2.4196    -0.9359    -0.4267	C.3	1	noname	0.1590
8	C3     4.3106     0.3853    -0.7588	C.3	1	noname	0.1140
9	O5     2.8381    -1.2469    -1.7553	O.3	1	noname	-0.3483
10	N1     1.7464    -1.9805     0.2572	N.3	1	noname	-0.0064
11	O6     3.7423     1.6780    -0.6098	O.3	1	noname	-0.3873
12	C4     3.8106    -0.2464    -2.0672	C.3	1	noname	0.1118
13	C5     1.9254    -3.3076     0.1290	C.2	1	noname	-0.0115
14	C6     0.8433    -1.7766     1.2440	C.2	1	noname	-0.0358
15	C7     4.9864    -0.8903    -2.8046	C.3	1	noname	0.0722
16	N2     2.7166    -4.0217    -0.7294	N.3	1	noname	0.0929
17	C8     1.1266    -3.9034     1.1112	C.2	1	noname	0.0554
18	N3     0.4598    -2.9611     1.7814	N.2	1	noname	-0.2138
19	O7     4.5242    -1.4741    -4.0137	O.3	1	noname	-0.3934
20	C9     2.7487    -5.3835    -0.6222	C.2	1	noname	0.0423
21	C10     1.1688    -5.3121     1.2205	C.2	1	noname	0.0561
22	N4     1.9876    -5.9866     0.3437	N.2	1	noname	-0.1701
23	N5     3.4907    -6.0962    -1.4251	N.2	1	noname	-0.2387
24	O8     0.4368    -5.9681     2.1458	O.3	1	noname	-0.2485
25	H1     5.5600    -0.7849     3.4881	H	1	noname	0.2283
26	H2     6.1417     2.0193     1.7465	H	1	noname	0.2283
27	H3     4.3530    -1.3616     0.6268	H	1	noname	0.0688
28	H4     1.6222    -0.1941    -0.4702	H	1	noname	0.0853
29	H5     5.3831     0.5620    -0.6777	H	1	noname	0.0658
30	H6     3.6524     1.8824     0.3238	H	1	noname	0.2106
31	H7     3.3051     0.4816    -2.7017	H	1	noname	0.0656
32	H8     0.4777    -0.7996     1.5601	H	1	noname	0.1016
33	H9     5.6702    -0.0973    -3.1072	H	1	noname	0.0591
34	H10     5.3493    -1.7218    -2.2004	H	1	noname	0.0591
35	H11     3.2688    -3.5506    -1.4317	H	1	noname	0.0682
36	H12     4.5529    -2.4307    -3.9387	H	1	noname	0.2101
37	H13     4.1046    -6.6859    -0.8815	H	1	noname	0.1893
38	H14     0.7253    -5.7096     3.0242	H	1	noname	0.2199
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	6	3	1
6	6	7	1
7	6	8	1
8	7	9	1
9	7	10	1
10	8	11	1
11	8	12	1
12	9	12	1
13	10	13	1
14	10	14	1
15	12	15	1
16	13	16	1
17	13	17	2
18	14	18	2
19	15	19	1
20	16	20	1
21	17	21	1
22	17	18	1
23	20	22	1
24	20	23	2
25	21	24	1
26	21	22	2
27	4	25	1
28	5	26	1
29	6	27	1
30	7	28	1
31	8	29	1
32	11	30	1
33	12	31	1
34	14	32	1
35	15	33	1
36	15	34	1
37	16	35	1
38	19	36	1
39	23	37	1
40	24	38	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1