@<TRIPOS>MOLECULE
DB03464
37 39 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -6.7180     0.9941     1.1823	P	1	noname	0.0149
2	O1    -7.2373     1.6585     2.3496	O.2	1	noname	-0.1967
3	O2    -5.3138     1.5399     0.8632	O.3	1	noname	-0.1525
4	O3    -6.6318    -0.5201     1.4492	O.3	1	noname	-0.1645
5	O4    -7.6531     1.2521    -0.0138	O.3	1	noname	-0.1645
6	C1    -4.8017     0.8848    -0.2879	C.3	1	noname	0.0914
7	C2    -3.4066     1.4270    -0.6050	C.3	1	noname	0.1114
8	O5    -2.5387     1.1876     0.5051	O.3	1	noname	-0.3606
9	C3    -2.8369     0.6911    -1.8239	C.3	1	noname	0.1113
10	C4    -1.2696     1.2702    -0.1195	C.3	1	noname	0.1281
11	O6    -2.8082     1.5715    -2.9377	O.3	1	noname	-0.3874
12	C5    -1.4179     0.3955    -1.3762	C.3	1	noname	0.1143
13	C6    -0.2140     0.8906     0.8307	C.2	1	noname	-0.0190
14	O7    -0.5059     0.8376    -2.3709	O.3	1	noname	-0.3871
15	N1     0.0285     1.5447     1.9883	N.3	1	noname	-0.0081
16	C7     0.6861    -0.1587     0.7587	C.2	1	noname	0.1045
17	N2     1.0068     0.9847     2.6411	N.2	1	noname	-0.2656
18	N3     0.8633    -1.1397    -0.1800	N.2	1	noname	-0.2344
19	C8     1.4425    -0.0660     1.9276	C.2	1	noname	0.0640
20	C9     1.8268    -2.0815     0.0204	C.2	1	noname	0.0515
21	C10     2.4391    -1.0420     2.1307	C.2	1	noname	0.0833
22	N4     2.5852    -2.0100     1.1608	N.2	1	noname	-0.2317
23	N5     3.2139    -1.0289     3.2239	N.3	1	noname	-0.1018
24	H1    -6.6228    -0.6782     2.3961	H	1	noname	0.2283
25	H2    -7.9408     0.4134    -0.3818	H	1	noname	0.2283
26	H3    -4.7005    -0.1630    -0.0053	H	1	noname	0.0605
27	H4    -5.4672     1.1674    -1.1036	H	1	noname	0.0605
28	H5    -3.4367     2.5065    -0.7531	H	1	noname	0.0656
29	H6    -3.4067    -0.1661    -2.1827	H	1	noname	0.0657
30	H7    -0.9920     2.2956    -0.3636	H	1	noname	0.0698
31	H8    -2.7873     1.0598    -3.7496	H	1	noname	0.2106
32	H9    -1.1825    -0.6617    -1.2544	H	1	noname	0.0660
33	H10     0.2700     1.2138    -1.9491	H	1	noname	0.2107
34	H11    -0.4649     2.3585     2.3266	H	1	noname	0.1752
35	H12     1.9868    -2.8719    -0.7129	H	1	noname	0.1062
36	H13     4.2196    -1.0240     3.1301	H	1	noname	0.1258
37	H14     2.7923    -1.0240     4.1417	H	1	noname	0.1258
@<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	12	14	1
15	13	15	1
16	13	16	2
17	15	17	1
18	16	18	1
19	16	19	1
20	17	19	2
21	18	20	2
22	19	21	1
23	20	22	1
24	21	23	1
25	21	22	2
26	4	24	1
27	5	25	1
28	6	26	1
29	6	27	1
30	7	28	1
31	9	29	1
32	10	30	1
33	11	31	1
34	12	32	1
35	14	33	1
36	15	34	1
37	20	35	1
38	23	36	1
39	23	37	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1