@<TRIPOS>MOLECULE
DB02762
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     3.4724    -0.7231    -0.0492	P	1	noname	0.0305
2	O1     4.4094    -1.7881    -0.2967	O.2	1	noname	-0.1933
3	O2     2.1491    -1.3143     0.4715	O.3	1	noname	-0.1063
4	O3     3.2115     0.0456    -1.3578	O.3	1	noname	-0.1623
5	O4     4.0544     0.2384     1.0036	O.3	1	noname	-0.1623
6	C1     1.2706    -0.3158     0.7035	C.2	1	noname	0.0495
7	C2     0.3820     0.1402    -0.3056	C.2	1	noname	0.0419
8	C3     1.1934     0.3259     1.9678	C.2	1	noname	-0.0047
9	N1     0.4070    -0.4382    -1.5471	N.2	1	noname	-0.1915
10	C4    -0.5655     1.2225    -0.0432	C.2	1	noname	0.0362
11	C5     0.2652     1.3847     2.2217	C.2	1	noname	-0.0416
12	C6    -0.4311    -0.0333    -2.5554	C.2	1	noname	0.0451
13	C7    -1.4334     1.6444    -1.0812	C.2	1	noname	-0.0175
14	C8    -0.6296     1.8532     1.2265	C.2	1	noname	-0.0360
15	C9    -0.3689    -0.6107    -3.7095	C.1	1	noname	0.0924
16	C10    -1.3658     1.0138    -2.3427	C.2	1	noname	0.0165
17	N2    -0.3136    -1.1237    -4.7350	N.1	1	noname	-0.1718
18	H1     3.0689    -0.5789    -2.0728	H	1	noname	0.2283
19	H2     3.8549    -0.0911     1.8830	H	1	noname	0.2283
20	H3     1.8631    -0.0024     2.7628	H	1	noname	0.0651
21	H4     0.2388     1.8503     3.2069	H	1	noname	0.0623
22	H5    -2.1485     2.4491    -0.9103	H	1	noname	0.0630
23	H6    -1.3338     2.6604     1.4279	H	1	noname	0.0629
24	H7    -2.0299     1.3327    -3.1460	H	1	noname	0.0653
@<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	1
7	6	8	2
8	7	9	2
9	7	10	1
10	8	11	1
11	9	12	1
12	10	13	2
13	10	14	1
14	11	14	2
15	12	15	1
16	12	16	2
17	13	16	1
18	15	17	3
19	4	18	1
20	5	19	1
21	8	20	1
22	11	21	1
23	13	22	1
24	14	23	1
25	16	24	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1