@<TRIPOS>MOLECULE
92169931
27 28 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     0.3237     0.2005    -1.8102	N.3	1	noname	-0.0802
2	N2    -4.4103    -3.1407     2.0021	N.3	1	noname	-0.3276
3	C1    -3.8839    -1.6267     0.1580	C.3	1	noname	0.0162
4	C2    -3.5163    -2.0647     1.5772	C.3	1	noname	0.0052
5	C3    -2.9912    -0.5522    -0.2663	C.2	1	noname	-0.0456
6	C4    -0.9090     0.2101    -1.2836	C.2	1	noname	-0.0912
7	C5    -1.7637    -0.8749    -0.9384	C.2	1	noname	-0.0452
8	C6    -1.2495     1.5473    -0.9947	C.2	1	noname	-0.0413
9	C7    -3.3525     0.8138    -0.0058	C.2	1	noname	-0.0549
10	C8    -2.4844     1.8930    -0.3812	C.2	1	noname	-0.0421
11	C9    -2.0705    -2.5647     1.5982	C.3	1	noname	-0.0497
12	C10    -0.1697     2.3433    -1.3442	C.2	1	noname	-0.0405
13	C11     0.7923     1.4651    -1.8464	C.2	1	noname	-0.1122
14	H1    -4.9140    -1.2705     0.1430	H	1	noname	0.0331
15	H2    -3.7822    -2.4731    -0.5212	H	1	noname	0.0331
16	H3    -3.6180    -1.2183     2.2564	H	1	noname	0.0462
17	H4    -1.5151    -1.8393    -1.1588	H	1	noname	0.0645
18	H5    -4.2399     1.0196     0.4531	H	1	noname	0.0625
19	H6    -2.7422     2.8658    -0.2151	H	1	noname	0.0629
20	H7    -1.4040    -1.7625     1.2814	H	1	noname	0.0246
21	H8    -1.8086    -2.8767     2.6092	H	1	noname	0.0246
22	H9    -1.9688    -3.4111     0.9189	H	1	noname	0.0246
23	H10     0.8009    -0.5869    -2.1155	H	1	noname	0.1522
24	H11    -0.0941     3.3564    -1.2537	H	1	noname	0.0642
25	H12    -5.3761    -2.8067     1.9880	H	1	noname	0.1186
26	H13    -4.3150    -3.9343     1.3652	H	1	noname	0.1186
27	H14     1.7129     1.7389    -2.1897	H	1	noname	0.0789
@<TRIPOS>BOND
1	1	6	1
2	1	13	1
3	1	23	1
4	4	2	1
5	2	25	1
6	2	26	1
7	3	4	1
8	3	5	1
9	3	14	1
10	3	15	1
11	4	11	1
12	4	16	1
13	5	7	2
14	5	9	1
15	6	7	1
16	6	8	2
17	7	17	1
18	8	10	1
19	8	12	1
20	9	10	2
21	9	18	1
22	10	19	1
23	11	20	1
24	11	21	1
25	11	22	1
26	12	13	2
27	12	24	1
28	13	27	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1