@<TRIPOS>MOLECULE
109374070
22 21 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -1.9716     1.0069    -0.2241	P	1	noname	0.0141
2	O1    -2.8198     0.8820    -1.5034	O.3	1	noname	-0.1946
3	O2    -1.9528     2.4758     0.2380	O.3	1	noname	-0.1946
4	O3    -2.5417     0.1851     0.8119	O.2	1	noname	-0.2307
5	C1     0.4128     0.6326     0.7355	C.3	1	noname	-0.0402
6	C2     1.8425     0.1705     0.4467	C.3	1	noname	-0.0527
7	C3    -0.4298     0.5085    -0.5355	C.3	1	noname	0.0549
8	C4     2.6851     0.2946     1.7177	C.3	1	noname	-0.0561
9	C5     4.1148    -0.1676     1.4289	C.3	1	noname	-0.0654
10	H1    -0.0187     0.0105     1.5197	H	1	noname	0.0275
11	H2     0.4261     1.6723     1.0625	H	1	noname	0.0275
12	H3     1.8292    -0.8692     0.1197	H	1	noname	0.0267
13	H4     2.2740     0.7925    -0.3375	H	1	noname	0.0267
14	H5    -0.4431    -0.5312    -0.8625	H	1	noname	0.0417
15	H6     0.0017     1.1306    -1.3197	H	1	noname	0.0417
16	H7     2.2536    -0.3275     2.5019	H	1	noname	0.0264
17	H8     2.6984     1.3343     2.0447	H	1	noname	0.0264
18	H9     4.7151    -0.0792     2.3344	H	1	noname	0.0230
19	H10     4.1015    -1.2073     1.1019	H	1	noname	0.0230
20	H11     4.5463     0.4545     0.6447	H	1	noname	0.0230
21	H12    -2.8686     2.7718     0.4230	H	1	noname	0.2259
22	H13    -3.7355     1.1780    -1.3184	H	1	noname	0.2259
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	1	4	2
4	1	7	1
5	2	22	1
6	3	21	1
7	5	6	1
8	5	7	1
9	5	10	1
10	5	11	1
11	6	8	1
12	6	12	1
13	6	13	1
14	7	14	1
15	7	15	1
16	8	9	1
17	8	16	1
18	8	17	1
19	9	18	1
20	9	19	1
21	9	20	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1