@<TRIPOS>MOLECULE
DB01805
28 27 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     1.8229    -0.2350    -0.4255	P	1	noname	0.0200
2	O1     2.7787    -1.0139     0.3184	O.2	1	noname	-0.1952
3	O2     1.3833    -1.0195    -1.6757	O.3	1	noname	-0.1516
4	O3     2.4682     1.0957    -0.8550	O.3	1	noname	-0.1520
5	O4     0.5951     0.0518     0.4587	O.3	1	noname	-0.1635
6	C1     0.7883    -2.2465    -1.2796	C.3	1	noname	0.0677
7	C2     1.5257     1.8637    -1.5886	C.3	1	noname	0.0872
8	C3     0.3516    -3.0259    -2.5216	C.3	1	noname	-0.0379
9	C4    -0.4316    -1.9616    -0.4012	C.3	1	noname	-0.0379
10	C5     2.1668     3.1858    -2.0154	C.3	1	noname	0.1159
11	N1     1.1963     3.9765    -2.7707	N.3	1	noname	-0.3175
12	C6     3.3308     2.9139    -2.8536	C.2	1	noname	0.1449
13	O5     4.4621     3.3112    -2.5001	O.2	1	noname	-0.2488
14	O6     3.1855     2.2335    -4.0105	O.3	1	noname	-0.2134
15	H1     0.8459    -0.0068     1.3835	H	1	noname	0.2283
16	H2     1.5614    -2.7798    -0.7264	H	1	noname	0.0607
17	H3     1.3155     1.2846    -2.4878	H	1	noname	0.0599
18	H4     0.7237     2.0888    -0.8855	H	1	noname	0.0599
19	H5     0.4215    -4.0953    -2.3227	H	1	noname	0.0257
20	H6    -0.6785    -2.7688    -2.7683	H	1	noname	0.0257
21	H7     1.0006    -2.7688    -3.3587	H	1	noname	0.0257
22	H8    -0.1467    -2.0281     0.6489	H	1	noname	0.0257
23	H9    -0.8061    -0.9602    -0.6133	H	1	noname	0.0257
24	H10    -1.2109    -2.6935    -0.6133	H	1	noname	0.0257
25	H11     2.4951     3.7751    -1.1592	H	1	noname	0.0596
26	H12     1.4137     4.9277    -3.0316	H	1	noname	0.1192
27	H13     0.3086     3.5716    -3.0316	H	1	noname	0.1192
28	H14     3.2079     1.2905    -3.8321	H	1	noname	0.2213
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	4	7	1
7	6	8	1
8	6	9	1
9	7	10	1
10	10	11	1
11	10	12	1
12	12	13	2
13	12	14	1
14	5	15	1
15	6	16	1
16	7	17	1
17	7	18	1
18	8	19	1
19	8	20	1
20	8	21	1
21	9	22	1
22	9	23	1
23	9	24	1
24	10	25	1
25	11	26	1
26	11	27	1
27	14	28	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1