@<TRIPOS>MOLECULE
DB03392
36 36 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -0.8956    -1.1638    -1.1002	P	1	noname	-0.0634
2	O1    -2.2019    -1.5715    -1.5487	O.2	1	noname	-0.2284
3	O2    -0.0119    -0.8408    -2.3193	O.3	1	noname	-0.1793
4	O3    -0.2530    -2.3033    -0.2877	O.3	1	noname	-0.1793
5	N1    -1.0287     0.1231    -0.1896	N.3	1	noname	0.0070
6	C1     0.1075    -1.9959    -3.1366	C.3	1	noname	0.0504
7	C2    -1.0678    -2.6010     0.8364	C.3	1	noname	0.0504
8	C3     0.3032     0.5388     0.2676	C.3	1	noname	0.1483
9	O4     0.8944    -0.5600     1.0374	O.3	1	noname	-0.3512
10	C4     0.0790     1.8888     1.0164	C.3	1	noname	0.1227
11	C5     1.7825    -0.2389     2.1480	C.3	1	noname	0.1113
12	O5     1.1546     2.7715     0.7331	O.3	1	noname	-0.3860
13	C6    -0.0011     1.6461     2.5441	C.3	1	noname	0.1124
14	C7     1.1614     0.7938     3.1396	C.3	1	noname	0.1111
15	C8     2.1385    -1.5209     2.9034	C.3	1	noname	0.0722
16	O6    -1.2445     1.0386     2.8623	O.3	1	noname	-0.3873
17	O7     2.1800     1.6560     3.6247	O.3	1	noname	-0.3874
18	O8     2.7898    -2.4242     2.0224	O.3	1	noname	-0.3934
19	H1    -1.8676     0.6220     0.0699	H	1	noname	0.1406
20	H2     0.1988    -2.8798    -2.5054	H	1	noname	0.0539
21	H3    -0.7777    -2.0888    -3.7660	H	1	noname	0.0539
22	H4     0.9929    -1.9058    -3.7660	H	1	noname	0.0539
23	H5    -1.1499    -3.6820     0.9496	H	1	noname	0.0539
24	H6    -0.6190    -2.1748     1.7336	H	1	noname	0.0539
25	H7    -2.0601    -2.1748     0.6890	H	1	noname	0.0539
26	H8     1.0316     0.6631    -0.5336	H	1	noname	0.0813
27	H9    -0.8099     2.4061     0.6553	H	1	noname	0.0671
28	H10     2.6583     0.1941     1.6647	H	1	noname	0.0656
29	H11     1.5366     3.0850     1.5562	H	1	noname	0.2107
30	H12    -0.0003     2.6193     3.0350	H	1	noname	0.0657
31	H13     0.7846     0.2557     4.0094	H	1	noname	0.0657
32	H14     2.8791    -1.2706     3.6630	H	1	noname	0.0591
33	H15     1.2091    -2.0132     3.1898	H	1	noname	0.0591
34	H16    -1.3425     0.9908     3.8161	H	1	noname	0.2106
35	H17     2.1736     1.6506     4.5846	H	1	noname	0.2106
36	H18     3.2650    -3.0832     2.5336	H	1	noname	0.2101
@<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	8	5	1
8	8	9	1
9	8	10	1
10	9	11	1
11	10	12	1
12	10	13	1
13	11	14	1
14	11	15	1
15	13	16	1
16	13	14	1
17	14	17	1
18	15	18	1
19	5	19	1
20	6	20	1
21	6	21	1
22	6	22	1
23	7	23	1
24	7	24	1
25	7	25	1
26	8	26	1
27	10	27	1
28	11	28	1
29	12	29	1
30	13	30	1
31	14	31	1
32	15	32	1
33	15	33	1
34	16	34	1
35	17	35	1
36	18	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1