@<TRIPOS>MOLECULE
71587248
24 25 1
SMALL
USER_CHARGES
@<TRIPOS>ATOM
1	N1     1.3461     2.0887     0.1627	N.2	1	noname	-0.1955
2	N2     0.0232     2.0834     0.0832	N.2	1	noname	-0.1955
3	N3    -2.0774     0.9970    -0.0683	N.3	1	noname	-0.0907
4	N4     3.4708     1.0397     0.2663	N.3	1	noname	-0.0907
5	N5    -2.4870     2.2750    -0.0695	N.3	1	noname	-0.2295
6	N6     3.8554     2.3250     0.2983	N.3	1	noname	-0.2295
7	C1    -0.0166    -0.2601     0.0363	C.2	1	noname	-0.0140
8	C2     1.4324    -0.2545     0.1462	C.2	1	noname	-0.0140
9	C3    -0.7406     0.9565     0.0142	C.2	1	noname	0.0353
10	C4     2.1343     0.9750     0.1946	C.2	1	noname	0.0353
11	C5    -0.7332    -1.4908    -0.0370	C.2	1	noname	-0.0189
12	C6     2.1591    -1.4771     0.2434	C.2	1	noname	-0.0189
13	C7     0.0086    -2.7126     0.0065	C.2	1	noname	-0.0362
14	C8     1.4289    -2.7033     0.1636	C.2	1	noname	-0.0362
15	H1    -1.7499    -1.4995    -0.1184	H	1	noname	0.0630
16	H2     3.1716    -1.4768     0.3664	H	1	noname	0.0630
17	H3    -0.4827    -3.6027    -0.0756	H	1	noname	0.0622
18	H4     1.9315    -3.5891     0.2198	H	1	noname	0.0622
19	H5     3.8576     0.6056    -0.5102	H	1	noname	0.1489
20	H6    -2.4625     0.5349     0.6926	H	1	noname	0.1489
21	H7    -3.5066     2.3060    -0.1325	H	1	noname	0.1377
22	H8    -2.1850     2.7304     0.7941	H	1	noname	0.1377
23	H9     4.8748     2.3743     0.3530	H	1	noname	0.1377
24	H10     3.4479     2.7822     1.1164	H	1	noname	0.1377
@<TRIPOS>BOND
1	1	2	1
2	1	10	2
3	2	9	2
4	3	5	1
5	3	9	1
6	3	20	1
7	4	6	1
8	4	10	1
9	4	19	1
10	5	21	1
11	5	22	1
12	6	23	1
13	6	24	1
14	7	8	1
15	7	9	1
16	7	11	2
17	8	10	1
18	8	12	2
19	11	13	1
20	11	15	1
21	12	14	1
22	12	16	1
23	13	14	2
24	13	17	1
25	14	18	1
@<TRIPOS>SUBSTRUCTURE
1	noname	1
