1
2  -ISIS-  04250616072D
3
4 13 14  0  0  0  0  0  0  0  0999 V2000
5   -0.9389   -1.9416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
6   -0.9401   -2.7690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
7   -0.2253   -3.1819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
8    0.4912   -2.7685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
9    0.4883   -1.9380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10   -0.2271   -1.5289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
11    1.2000   -1.5250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
12    1.9125   -1.9375    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
13    1.9976   -2.7563    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
14    2.8027   -2.9285    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
15    3.2152   -2.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
16    2.6650   -1.6035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
17    2.8374   -0.7968    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
18  1  2  2  0  0  0  0
19  5  7  1  0  0  0  0
20  3  4  2  0  0  0  0
21  7  8  1  0  0  0  0
22  8  9  1  0  0  0  0
23  4  5  1  0  0  0  0
24  2  3  1  0  0  0  0
25  5  6  2  0  0  0  0
26  9 10  2  0  0  0  0
27 10 11  1  0  0  0  0
28 11 12  1  0  0  0  0
29 12  8  1  0  0  0  0
30  6  1  1  0  0  0  0
31 12 13  2  0  0  0  0
32M  END
33