@<TRIPOS>MOLECULE
DB04214
20 20 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -1.0035    -1.9244     0.8191	P	1	noname	0.0291
2	O1    -2.3415    -2.4444     0.9331	O.2	1	noname	-0.1935
3	O2    -0.9501    -0.8905    -0.3211	O.3	1	noname	-0.1133
4	O3    -0.6006    -1.2494     2.1433	O.3	1	noname	-0.1624
5	O4    -0.0291    -3.0769     0.5130	O.3	1	noname	-0.1624
6	C1     0.3043    -0.4029    -0.4279	C.2	1	noname	0.0421
7	C2     1.2236    -1.0267    -1.2633	C.2	1	noname	0.0158
8	C3     0.6765     0.7229     0.2975	C.2	1	noname	0.0158
9	C4     2.5151    -0.5246    -1.3734	C.2	1	noname	0.0414
10	C5     1.9679     1.2249     0.1874	C.2	1	noname	0.0414
11	C6     2.8872     0.6011    -0.6480	C.2	1	noname	0.0363
12	N1     4.0998     1.0725    -0.7513	N.2	1	noname	-0.0167
13	O5     4.9867     0.3531    -0.9818	O.2	1	noname	-0.1449
14	O6     4.3121     2.3105    -0.6011	O.3	1	noname	-0.1449
15	H1    -0.4014    -1.9227     2.7980	H	1	noname	0.2283
16	H2     0.2895    -3.4538     1.3365	H	1	noname	0.2283
17	H3     0.9317    -1.9095    -1.8322	H	1	noname	0.0651
18	H4    -0.0444     1.2120     0.9526	H	1	noname	0.0651
19	H5     3.2359    -1.0138    -2.0285	H	1	noname	0.0648
20	H6     2.2598     2.1077     0.7563	H	1	noname	0.0648
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	6	7	2
7	6	8	1
8	7	9	1
9	8	10	2
10	9	11	2
11	10	11	1
12	11	12	1
13	12	13	2
14	12	14	1
15	4	15	1
16	5	16	1
17	7	17	1
18	8	18	1
19	9	19	1
20	10	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1