c1c1pyrr.zmat

c1c1pyrr+

1   N4
2   C1  1  1.471
3   C1  1  1.471  2  109.5
4   C2  2  1.529  1  109.5   3    0.0
5   C2  3  1.529  1  109.5   2    0.0
6   C1  1  1.471  2  109.5   3  120.0
7   C1  1  1.471  2  109.5   3  240.0
8   H1  2  1.090  1  109.5   6    0.0
9   H1  2  1.090  1  109.5   7    0.0  
10  H1  3  1.090  1  109.5   6    0.0
11  H1  3  1.090  1  109.5   7    0.0
12  HC  4  1.090  2  110.7   8    0.0
13  HC  4  1.090  2  110.7   9    0.0
14  HC  5  1.090  3  110.7  10    0.0
15  HC  5  1.090  3  110.7  11    0.0
16  H1  6  1.090  1  109.5   2   60.0
17  H1  6  1.090  1  109.5  16  120.0
18  H1  6  1.090  1  109.5  16  240.0
19  H1  7  1.090  1  109.5   3   60.0
20  H1  7  1.090  1  109.5  19  120.0
21  H1  7  1.090  1  109.5  19  240.0

connect 5 4

il.ff