@<TRIPOS>MOLECULE
DB01695
19 18 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     3.5699    -1.5214    -0.6570	P	1	noname	-0.3354
2	O1     4.0762    -2.8618    -0.5132	O.2	1	noname	-0.5665
3	O2     4.4588    -0.5487     0.1401	O.3	1	noname	-0.5665
4	O3     3.5814    -1.1252    -2.1451	O.3	1	noname	-0.5665
5	C1     2.0251    -1.4523    -0.0813	C.3	1	noname	-0.0108
6	C2     1.4872    -0.0281    -0.2340	C.3	1	noname	-0.0459
7	C3     0.0548     0.0360     0.2998	C.3	1	noname	0.0229
8	C4    -0.4585     1.3950     0.1540	C.2	1	noname	0.0827
9	O4    -1.6187     1.6686     0.5305	O.2	1	noname	-0.2825
10	N1     0.3141     2.3490    -0.3832	N.3	1	noname	0.0121
11	O5    -0.1430     3.5591    -0.5130	O.3	1	noname	-0.3197
12	H1     1.3973    -2.0703    -0.7232	H	1	noname	0.0242
13	H2     2.0560    -1.6375     0.9924	H	1	noname	0.0242
14	H3     2.0925     0.6078     0.4120	H	1	noname	0.0267
15	H4     1.4338     0.1751    -1.3036	H	1	noname	0.0267
16	H5    -0.5646    -0.5890    -0.3436	H	1	noname	0.0361
17	H6     0.0941    -0.1562     1.3720	H	1	noname	0.0361
18	H7     1.2546     2.1531    -0.6949	H	1	noname	0.1640
19	H8    -0.2874     3.9414     0.3556	H	1	noname	0.2380
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	5	6	1
6	6	7	1
7	7	8	1
8	8	9	2
9	8	10	1
10	10	11	1
11	5	12	1
12	5	13	1
13	6	14	1
14	6	15	1
15	7	16	1
16	7	17	1
17	10	18	1
18	11	19	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
