@<TRIPOS>MOLECULE
71312811
36 37 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1    -0.1911    -2.2298    -0.0361	O.3	1	noname	-0.1460
2	O2    -0.4451    -4.4724     0.2061	O.2	1	noname	-0.2509
3	N1     1.0441     2.2236     0.7347	N.3	1	noname	-0.0887
4	N2     4.1690    -2.6723     0.0071	N.3	1	noname	-0.3090
5	C1     1.6949     0.1153     0.8252	C.2	1	noname	-0.0238
6	C2     2.5400    -1.0544     1.0789	C.3	1	noname	0.0253
7	C3     0.4062     0.1234     0.2995	C.2	1	noname	0.0010
8	C4     3.3478    -1.4359    -0.1899	C.3	1	noname	0.0017
9	C5     0.0148     1.4733     0.3001	C.2	1	noname	-0.0796
10	C6     2.0722     1.4323     1.0679	C.2	1	noname	-0.1309
11	C7    -0.4902    -0.8934    -0.1527	C.2	1	noname	0.0269
12	C8    -1.2725     1.8629    -0.1079	C.2	1	noname	-0.0446
13	C9    -1.7227    -0.4775    -0.6794	C.2	1	noname	-0.0088
14	C10    -2.1554     0.8578    -0.5645	C.2	1	noname	-0.0371
15	C11     5.0171    -2.9298    -1.1956	C.3	1	noname	-0.0136
16	C12     3.3634    -3.8910     0.3410	C.3	1	noname	-0.0136
17	C13    -0.9721    -3.3380     0.2239	C.2	1	noname	0.1568
18	C14    -2.3883    -3.3495     0.5878	C.3	1	noname	0.0224
19	H1     1.8437    -1.8292     1.3848	H	1	noname	0.0329
20	H2     3.2237    -0.9036     1.9257	H	1	noname	0.0329
21	H3     2.6713    -1.5720    -1.0411	H	1	noname	0.0433
22	H4     3.9982    -0.5843    -0.4381	H	1	noname	0.0433
23	H5     2.9851     1.7419     1.4439	H	1	noname	0.0792
24	H6     1.0346     3.2003     0.7907	H	1	noname	0.1522
25	H7    -1.5504     2.8472    -0.0887	H	1	noname	0.0642
26	H8    -2.3378    -1.1418    -1.1368	H	1	noname	0.0650
27	H9    -3.1011     1.1096    -0.8026	H	1	noname	0.0624
28	H10     5.6592    -3.7964    -1.0335	H	1	noname	0.0394
29	H11     4.3889    -3.1238    -2.0682	H	1	noname	0.0394
30	H12     5.6706    -2.0849    -1.4244	H	1	noname	0.0394
31	H13     4.0056    -4.7628     0.4611	H	1	noname	0.0394
32	H14     2.6354    -4.0749    -0.4510	H	1	noname	0.0394
33	H15     2.8255    -3.8026     1.2906	H	1	noname	0.0394
34	H16    -2.9840    -3.0572    -0.2958	H	1	noname	0.0336
35	H17    -2.6743    -4.3530     0.9030	H	1	noname	0.0336
36	H18    -2.5820    -2.5912     1.3465	H	1	noname	0.0336
@<TRIPOS>BOND
1	1	11	1
2	1	17	1
3	2	17	2
4	3	9	1
5	3	10	1
6	3	24	1
7	4	8	1
8	4	15	1
9	4	16	1
10	5	6	1
11	5	7	1
12	5	10	2
13	6	8	1
14	6	19	1
15	6	20	1
16	7	9	2
17	7	11	1
18	8	21	1
19	8	22	1
20	9	12	1
21	10	23	1
22	11	13	2
23	12	14	2
24	12	25	1
25	13	14	1
26	13	26	1
27	14	27	1
28	15	28	1
29	15	29	1
30	15	30	1
31	16	31	1
32	16	32	1
33	16	33	1
34	17	18	1
35	18	34	1
36	18	35	1
37	18	36	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1