@<TRIPOS>MOLECULE
DB03846
37 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -4.6779    -3.1938    -2.0870	P	1	noname	0.0149
2	O1    -5.5111    -2.3380    -2.8914	O.2	1	noname	-0.1967
3	O2    -3.8234    -2.3333    -1.1379	O.3	1	noname	-0.1525
4	O3    -5.5644    -4.1438    -1.2605	O.3	1	noname	-0.1645
5	O4    -3.7549    -4.0193    -3.0025	O.3	1	noname	-0.1645
6	C1    -3.0017    -3.1771    -0.3447	C.3	1	noname	0.0913
7	C2    -2.1527    -2.3222     0.5983	C.3	1	noname	0.1100
8	O5    -3.0093    -1.5560     1.4479	O.3	1	noname	-0.3537
9	C3    -1.2756    -3.2341     1.4647	C.3	1	noname	0.0864
10	C4    -2.1148    -1.2300     2.5157	C.3	1	noname	0.1256
11	O6     0.0593    -3.2052     0.9815	O.3	1	noname	-0.3900
12	C5    -1.3416    -2.5347     2.8157	C.3	1	noname	0.0167
13	N1    -2.8349    -0.5588     3.5682	N.3	1	noname	0.0591
14	C6    -2.8947     0.8150     3.4790	C.2	1	noname	0.1095
15	C7    -3.4747    -1.2332     4.6030	C.2	1	noname	-0.0304
16	O7    -2.3354     1.4256     2.5426	O.2	1	noname	-0.2475
17	N2    -3.5872     1.4904     4.4500	N.2	1	noname	-0.1253
18	C8    -4.1887    -0.5665     5.6327	C.2	1	noname	0.0403
19	C9    -4.2119     0.8473     5.4950	C.2	1	noname	0.0515
20	C10    -4.8403    -1.2699     6.7337	C.3	1	noname	0.0734
21	O8    -4.8671     1.5833     6.4178	O.3	1	noname	-0.2545
22	O9    -4.2856    -0.8362     7.9668	O.3	1	noname	-0.3913
23	H1    -5.4172    -3.9860    -0.3251	H	1	noname	0.2283
24	H2    -3.1621    -4.5496    -2.4649	H	1	noname	0.2283
25	H3    -3.6896    -3.7667     0.2614	H	1	noname	0.0605
26	H4    -2.3312    -3.6732    -1.0464	H	1	noname	0.0605
27	H5    -1.5552    -1.6008     0.0410	H	1	noname	0.0656
28	H6    -1.5289    -4.2943     1.4639	H	1	noname	0.0630
29	H7    -1.4134    -0.4302     2.2782	H	1	noname	0.0788
30	H8     0.6681    -3.1921     1.7236	H	1	noname	0.2105
31	H9    -1.9524    -3.1481     3.4781	H	1	noname	0.0335
32	H10    -0.3241    -2.2694     3.1027	H	1	noname	0.0335
33	H11    -3.4144    -2.3215     4.6071	H	1	noname	0.0763
34	H12    -5.8852    -0.9596     6.7424	H	1	noname	0.0616
35	H13    -4.5862    -2.3256     6.6384	H	1	noname	0.0616
36	H14    -4.6111     1.2957     7.2972	H	1	noname	0.2199
37	H15    -4.0472    -1.6003     8.4968	H	1	noname	0.2105
@<TRIPOS>BOND
1	1	2	2
2	1	3	1
3	1	4	1
4	1	5	1
5	3	6	1
6	7	6	1
7	7	8	1
8	7	9	1
9	8	10	1
10	9	11	1
11	9	12	1
12	10	13	1
13	10	12	1
14	13	14	1
15	13	15	1
16	14	16	2
17	14	17	1
18	15	18	2
19	17	19	2
20	18	20	1
21	18	19	1
22	19	21	1
23	20	22	1
24	4	23	1
25	5	24	1
26	6	25	1
27	6	26	1
28	7	27	1
29	9	28	1
30	10	29	1
31	11	30	1
32	12	31	1
33	12	32	1
34	15	33	1
35	20	34	1
36	20	35	1
37	21	36	1
38	22	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1