@<TRIPOS>MOLECULE
72941491
38 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     1.1640     0.0642    -0.3411	P	1	noname	-0.0180
2	P2     2.3047     1.8807     0.9717	P	1	noname	0.0547
3	O1     1.8007     1.4641    -0.4226	O.3	1	noname	-0.0495
4	O2     2.2144    -0.9497     0.1492	O.3	1	noname	-0.1822
5	O3     0.6927    -0.3254    -1.6448	O.2	1	noname	-0.2201
6	O4     2.9414     3.2806     0.8902	O.3	1	noname	-0.1591
7	O5     3.3551     0.8668     1.4619	O.3	1	noname	-0.1591
8	O6     1.1986     1.9094     1.8932	O.2	1	noname	-0.1881
9	N1    -0.0512     0.0957     0.6713	N.3	1	noname	0.0031
10	C1    -1.2776     0.4328    -0.0497	C.3	1	noname	0.0116
11	C2    -0.1988    -1.2176     1.2966	C.3	1	noname	0.0116
12	C3    -1.3741    -1.1871     2.2757	C.3	1	noname	-0.0398
13	C4    -1.1231     1.8072    -0.7040	C.3	1	noname	-0.0398
14	C5    -1.5286    -2.5615     2.9300	C.3	1	noname	-0.0549
15	C6    -2.4065     2.1600    -1.4586	C.3	1	noname	-0.0549
16	C7    -2.7039    -2.5310     3.9091	C.3	1	noname	-0.0653
17	C8    -2.2520     3.5343    -2.1129	C.3	1	noname	-0.0653
18	H1    -0.3859    -1.9671     0.5276	H	1	noname	0.0439
19	H2     0.7155    -1.4689     1.8341	H	1	noname	0.0439
20	H3    -2.1149     0.4545     0.6478	H	1	noname	0.0439
21	H4    -1.4646    -0.3167    -0.8187	H	1	noname	0.0439
22	H5    -2.2884    -0.9358     1.7381	H	1	noname	0.0280
23	H6    -1.1871    -0.4375     3.0446	H	1	noname	0.0280
24	H7    -0.9361     2.5567     0.0649	H	1	noname	0.0280
25	H8    -0.2858     1.7855    -1.4016	H	1	noname	0.0280
26	H9    -3.2438     2.1817    -0.7610	H	1	noname	0.0264
27	H10    -2.5936     1.4104    -2.2275	H	1	noname	0.0264
28	H11    -1.7156    -3.3110     2.1610	H	1	noname	0.0264
29	H12    -0.6143    -2.8128     3.4676	H	1	noname	0.0264
30	H13    -3.1664     3.7856    -2.6505	H	1	noname	0.0230
31	H14    -2.0650     4.2839    -1.3439	H	1	noname	0.0230
32	H15    -1.4147     3.5126    -2.8104	H	1	noname	0.0230
33	H16    -2.8139    -3.5101     4.3752	H	1	noname	0.0230
34	H17    -3.6182    -2.2797     3.3715	H	1	noname	0.0230
35	H18    -2.5168    -1.7814     4.6781	H	1	noname	0.0230
36	H19     2.9672    -0.9692    -0.4780	H	1	noname	0.2273
37	H20     3.6759     1.1319     2.3492	H	1	noname	0.2283
38	H21     3.6942     3.2611     0.2630	H	1	noname	0.2283
@<TRIPOS>BOND
1	1	3	1
2	1	4	1
3	1	5	2
4	1	9	1
5	2	3	1
6	2	6	1
7	2	7	1
8	2	8	2
9	4	36	1
10	6	38	1
11	7	37	1
12	9	10	1
13	9	11	1
14	10	13	1
15	10	20	1
16	10	21	1
17	11	12	1
18	11	18	1
19	11	19	1
20	12	14	1
21	12	22	1
22	12	23	1
23	13	15	1
24	13	24	1
25	13	25	1
26	14	16	1
27	14	28	1
28	14	29	1
29	15	17	1
30	15	26	1
31	15	27	1
32	16	33	1
33	16	34	1
34	16	35	1
35	17	30	1
36	17	31	1
37	17	32	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1