C (  1)       0.000000  0        0.000000  0        0.000000  0    0   0   0
C (  2)       1.478621  1        0.000000  0        0.000000  0    1   0   0
C (  3)       1.641254  1       93.139016  1        0.000000  0    2   1   0
C (  4)       1.522103  1      109.324863  1      356.298305  1    3   2   1
C (  5)       1.523767  1      114.006380  1       85.739977  1    2   1   3
C (  6)       1.346781  1       95.063168  1      269.915345  1    5   2   1
C (  7)       1.432766  1      121.208216  1      310.742066  1    4   3   2
C (  8)       1.381108  1      109.204417  1       39.321415  1    7   4   3
H (  9)       1.083472  1      128.853677  1      181.238831  1    5   2   6
H ( 10)       1.083549  1      135.125596  1      179.160612  1    6   5   2
H ( 11)       1.093749  1      123.046658  1      181.160041  1    7   4   8
H ( 12)       1.087948  1      128.676578  1      211.510912  1    8   7   4
H ( 13)       1.097315  1      120.254118  1      266.240127  1    1   2   3
C ( 14)       1.478734  1      117.972635  1      148.975036  1    2   1   5
H ( 15)       1.106038  1      116.404082  1      231.321751  1    3   2   4
C ( 16)       1.433702  1      116.402449  1      195.686392  1    4   3   7
H ( 17)       1.107488  1      109.233276  1       52.796242  1   14   2   1
H ( 18)       1.105878  1      111.908518  1      356.912729  1   16   4   3
S ( 19)       1.552081  1      128.335902  1      180.570527  1   14   2  17
S ( 20)       1.581063  1      127.823158  1      181.258970  1   16   4  18
              0.000000  0        0.000000  0        0.000000  0