@<TRIPOS>MOLECULE
60196326
34 34 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	O1     1.5676    -1.1011    -0.9388	O.3	1	noname	-0.2793
2	O2    -1.0628     3.6893    -0.5343	O.3	1	noname	-0.2798
3	N1    -1.8793    -2.8034     1.2632	N.3	1	noname	-0.3276
4	C1    -1.1744    -1.1487    -0.3904	C.3	1	noname	0.0263
5	C2    -1.1475    -1.5503     1.0857	C.3	1	noname	0.0053
6	C3    -0.4435     0.1027    -0.5677	C.2	1	noname	-0.0268
7	C4     0.9196     0.0790    -0.8392	C.2	1	noname	-0.0187
8	C5    -1.1107     1.3178    -0.4651	C.2	1	noname	-0.0264
9	C6     0.3024    -1.7382     1.5368	C.3	1	noname	-0.0497
10	C7     0.9482     2.4855    -0.9053	C.2	1	noname	-0.0269
11	C8    -0.4148     2.5092    -0.6339	C.2	1	noname	-0.0215
12	C9     1.6154     1.2704    -1.0080	C.2	1	noname	-0.0290
13	C10     1.6791     3.7369    -1.0826	C.3	1	noname	0.0100
14	C11     1.5328    -1.5479    -2.2863	C.3	1	noname	0.0423
15	C12    -1.0281     4.1360     0.8132	C.3	1	noname	0.0423
16	H1    -2.2073    -1.0148    -0.7118	H	1	noname	0.0332
17	H2    -0.7063    -1.9307    -0.9883	H	1	noname	0.0332
18	H3    -1.6155    -0.7683     1.6836	H	1	noname	0.0462
19	H4    -2.1109     1.3352    -0.2659	H	1	noname	0.0654
20	H5     0.8481    -0.8039     1.4044	H	1	noname	0.0246
21	H6     0.3216    -2.0243     2.5884	H	1	noname	0.0246
22	H7     0.7705    -2.5202     0.9389	H	1	noname	0.0246
23	H8     2.6156     1.2530    -1.2071	H	1	noname	0.0653
24	H9    -2.8478    -2.6779     0.9619	H	1	noname	0.1186
25	H10    -1.8614    -3.0716     2.2492	H	1	noname	0.1186
26	H11     2.1202     3.7620    -2.0791	H	1	noname	0.0280
27	H12     0.9944     4.5771    -0.9671	H	1	noname	0.0280
28	H13     2.4684     3.8058    -0.3341	H	1	noname	0.0280
29	H14     2.0560    -2.5007    -2.3667	H	1	noname	0.0535
30	H15     0.4968    -1.6746    -2.6004	H	1	noname	0.0535
31	H16     2.0190    -0.8112    -2.9259	H	1	noname	0.0535
32	H17    -1.5513     5.0889     0.8937	H	1	noname	0.0535
33	H18    -1.5143     3.3994     1.4528	H	1	noname	0.0535
34	H19     0.0079     4.2627     1.1274	H	1	noname	0.0535
@<TRIPOS>BOND
1	1	7	1
2	1	14	1
3	2	11	1
4	2	15	1
5	5	3	1
6	3	24	1
7	3	25	1
8	4	5	1
9	4	6	1
10	4	16	1
11	4	17	1
12	5	9	1
13	5	18	1
14	6	7	2
15	6	8	1
16	7	12	1
17	8	11	2
18	8	19	1
19	9	20	1
20	9	21	1
21	9	22	1
22	10	11	1
23	10	12	2
24	10	13	1
25	12	23	1
26	13	26	1
27	13	27	1
28	13	28	1
29	14	29	1
30	14	30	1
31	14	31	1
32	15	32	1
33	15	33	1
34	15	34	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1