@<TRIPOS>MOLECULE
91617818
36 38 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	P1     7.1275    -1.0503     2.3949	P	1	noname	0.0149
2	O1     5.1169    -3.9666     0.0658	O.3	1	noname	-0.3483
3	O2     1.9508    -5.4564     0.5565	O.3	1	noname	-0.3857
4	O3     1.9857    -2.9464     0.1202	O.3	1	noname	-0.3873
5	O4     6.3835    -1.7309     1.2308	O.3	1	noname	-0.1525
6	O5     7.0691   -10.0279    -1.7470	O.2	1	noname	-0.2483
7	O6     8.5155    -0.5863     1.9156	O.3	1	noname	-0.1645
8	O7     7.2927    -2.0512     3.5536	O.3	1	noname	-0.1645
9	O8     6.3708     0.0880     2.8480	O.2	1	noname	-0.1967
10	N1     4.8337    -6.3654    -0.3393	N.3	1	noname	0.0142
11	N2     5.2927    -8.5483     0.0183	N.2	1	noname	-0.2102
12	N3     6.2205    -6.1129    -2.3812	N.3	1	noname	0.0710
13	N4     7.3127    -8.1232    -2.9883	N.2	1	noname	-0.1643
14	C1     3.1865    -4.8560     0.9155	C.3	1	noname	0.1257
15	C2     3.0098    -3.3608     1.0124	C.3	1	noname	0.1127
16	C3     4.2095    -5.0565    -0.2291	C.3	1	noname	0.1577
17	C4     4.3646    -2.8349     0.5163	C.3	1	noname	0.1130
18	C5     5.1037    -2.1588     1.6728	C.3	1	noname	0.0914
19	C6     5.6903    -6.7654    -1.3076	C.2	1	noname	0.0081
20	C7     4.6258    -7.4624     0.4428	C.2	1	noname	-0.0356
21	C8     5.9494    -8.1182    -1.0606	C.2	1	noname	0.0587
22	C9     6.7975    -8.8216    -1.9303	C.2	1	noname	0.1389
23	C10     7.0478    -6.7956    -3.2424	C.2	1	noname	0.0169
24	H1     3.6470    -5.2274     1.8310	H	1	noname	0.0674
25	H2     2.7693    -3.0513     2.0295	H	1	noname	0.0657
26	H3     3.7353    -4.8659    -1.2151	H	1	noname	0.0852
27	H4     4.1823    -2.1194    -0.2855	H	1	noname	0.0657
28	H5     4.5309    -1.2972     2.0157	H	1	noname	0.0605
29	H6     5.2206    -2.8672     2.4929	H	1	noname	0.0605
30	H7     1.2773    -5.2505     1.2380	H	1	noname	0.2107
31	H8     1.8709    -1.9752     0.1831	H	1	noname	0.2106
32	H9     4.0247    -7.4590     1.2669	H	1	noname	0.1016
33	H10     6.0164    -5.1774    -2.5359	H	1	noname	0.0659
34	H11     7.4564    -6.3287    -4.0520	H	1	noname	0.0841
35	H12     9.0305    -1.3610     1.6072	H	1	noname	0.2283
36	H13     7.8076    -2.8259     3.2452	H	1	noname	0.2283
@<TRIPOS>BOND
1	1	5	1
2	1	7	1
3	1	8	1
4	1	9	2
5	2	16	1
6	2	17	1
7	14	3	1
8	3	30	1
9	15	4	1
10	4	31	1
11	5	18	1
12	6	22	2
13	7	35	1
14	8	36	1
15	16	10	1
16	10	19	1
17	10	20	1
18	11	20	2
19	11	21	1
20	12	19	1
21	12	23	1
22	12	33	1
23	13	22	1
24	13	23	2
25	14	15	1
26	14	16	1
27	14	24	1
28	15	17	1
29	15	25	1
30	16	26	1
31	17	18	1
32	17	27	1
33	18	28	1
34	18	29	1
35	19	21	2
36	20	32	1
37	21	22	1
38	23	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1