@<TRIPOS>MOLECULE
60106278
36 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1    -1.5981    -5.9794    -0.2148	P	1	noname	0.0141
2	O1    -0.8271    -7.3111    -0.2765	O.3	1	noname	-0.1946
3	O2    -2.3852    -5.9026     1.1066	O.3	1	noname	-0.1946
4	O3    -2.5135    -5.9030    -1.3238	O.2	1	noname	-0.2307
5	O4    -5.2965    -1.4653     0.1244	O.2	1	noname	-0.2442
6	O5    -5.7873     1.2433     0.1888	O.2	1	noname	-0.2442
7	O6     2.1353     2.1283    -1.2022	O.3	1	noname	-0.2256
8	O7     1.4987     2.8530     0.6865	O.2	1	noname	-0.2567
9	N1    -3.1314    -1.0538    -0.0561	N.3	1	noname	-0.1143
10	N2    -3.5454     1.6193    -0.0003	N.3	1	noname	-0.1110
11	N3     1.2689     2.2261    -0.2735	N.2	1	noname	-0.2081
12	C1    -0.3044    -2.2276    -0.3065	C.3	1	noname	-0.0253
13	C2    -1.2982    -3.3995    -0.2327	C.3	1	noname	-0.0361
14	C3    -0.7354    -0.8000    -0.2707	C.2	1	noname	-0.0064
15	C4    -2.0390    -0.2562    -0.1464	C.2	1	noname	0.0040
16	C5    -0.5322    -4.7225    -0.2940	C.3	1	noname	0.0552
17	C6    -2.2578     1.1598    -0.1232	C.2	1	noname	0.0193
18	C7     0.3317     0.1155    -0.3577	C.2	1	noname	0.0012
19	C8     0.1532     1.5167    -0.3033	C.2	1	noname	0.0266
20	C9    -1.1649     2.0544    -0.2083	C.2	1	noname	0.0220
21	C10    -4.3996    -0.6007     0.0551	C.2	1	noname	0.1746
22	C11    -4.6223     0.7843     0.0864	C.2	1	noname	0.1748
23	H1     0.3764    -2.3807    -1.1439	H	1	noname	0.0316
24	H2     0.4030    -2.3498     0.5137	H	1	noname	0.0316
25	H3    -1.9911    -3.3416    -1.0722	H	1	noname	0.0278
26	H4    -1.8553    -3.3451     0.7026	H	1	noname	0.0278
27	H5     0.0249    -4.7768    -1.2293	H	1	noname	0.0417
28	H6     0.1607    -4.7803     0.5455	H	1	noname	0.0417
29	H7     1.3175    -0.2125    -0.4176	H	1	noname	0.0659
30	H8    -1.3436     3.0831    -0.1724	H	1	noname	0.0673
31	H9    -3.0155    -2.0084    -0.0747	H	1	noname	0.1376
32	H10    -3.6822     2.5939     0.0203	H	1	noname	0.1376
33	H11    -3.0183    -6.6492     1.1536	H	1	noname	0.2259
34	H12    -1.4602    -8.0576    -0.2295	H	1	noname	0.2259
35	H13     2.9367     2.6359    -0.9562	H	1	noname	0.2597
36	H14     0.8444     2.9749    -0.6387	H	1	noname	0.2774
@<TRIPOS>BOND
1	1	2	1
2	1	3	1
3	1	4	2
4	1	16	1
5	2	34	1
6	3	33	1
7	5	21	2
8	6	22	2
9	7	11	1
10	7	35	1
11	8	11	2
12	9	15	1
13	9	21	1
14	9	31	1
15	10	17	1
16	10	22	1
17	10	32	1
18	11	19	1
19	11	36	1
20	12	13	1
21	12	14	1
22	12	23	1
23	12	24	1
24	13	16	1
25	13	25	1
26	13	26	1
27	14	15	2
28	14	18	1
29	15	17	1
30	16	27	1
31	16	28	1
32	17	20	2
33	18	19	2
34	18	29	1
35	19	20	1
36	20	30	1
37	21	22	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1