@<TRIPOS>MOLECULE
DB01577
26 26 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1    -2.8315    -1.8183     1.2584	N.3	1	noname	-0.3169
2	C1    -1.6947    -0.9977     0.8439	C.3	1	noname	0.0077
3	C2    -4.0081    -1.4546     0.4705	C.3	1	noname	-0.0161
4	C3    -1.4082    -1.2354    -0.6401	C.3	1	noname	0.0145
5	C4    -0.4634    -1.3783     1.6685	C.3	1	noname	-0.0494
6	C5    -0.2730    -0.4159    -1.0539	C.2	1	noname	-0.0568
7	C6     1.0188    -0.9209    -0.9624	C.2	1	noname	-0.0634
8	C7    -0.4840     0.8694    -1.5394	C.2	1	noname	-0.0634
9	C8     2.0996    -0.1406    -1.3564	C.2	1	noname	-0.0629
10	C9     0.5968     1.6496    -1.9334	C.2	1	noname	-0.0629
11	C10     1.8886     1.1446    -1.8419	C.2	1	noname	-0.0682
12	H1    -2.8077    -2.5269     1.9777	H	1	noname	0.1221
13	H2    -1.9701     0.0420     1.0210	H	1	noname	0.0465
14	H3    -4.8296    -1.2006     1.1403	H	1	noname	0.0391
15	H4    -3.7731    -0.5957    -0.1582	H	1	noname	0.0391
16	H5    -4.2988    -2.2962    -0.1582	H	1	noname	0.0391
17	H6    -1.0867    -2.2709    -0.7515	H	1	noname	0.0332
18	H7    -2.2652    -0.8671    -1.2040	H	1	noname	0.0332
19	H8    -0.7001    -1.3051     2.7300	H	1	noname	0.0246
20	H9    -0.1693    -2.4008     1.4315	H	1	noname	0.0246
21	H10     0.3564    -0.7002     1.4315	H	1	noname	0.0246
22	H11     1.1843    -1.9287    -0.5817	H	1	noname	0.0625
23	H12    -1.4970     1.2654    -1.6111	H	1	noname	0.0625
24	H13     3.1126    -0.5366    -1.2847	H	1	noname	0.0622
25	H14     0.4313     2.6575    -2.3141	H	1	noname	0.0622
26	H15     2.7361     1.7565    -2.1509	H	1	noname	0.0622
@<TRIPOS>BOND
1	2	1	1
2	1	3	1
3	2	4	1
4	2	5	1
5	4	6	1
6	6	7	2
7	6	8	1
8	7	9	1
9	8	10	2
10	9	11	2
11	10	11	1
12	1	12	1
13	2	13	1
14	3	14	1
15	3	15	1
16	3	16	1
17	4	17	1
18	4	18	1
19	5	19	1
20	5	20	1
21	5	21	1
22	7	22	1
23	8	23	1
24	9	24	1
25	10	25	1
26	11	26	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1