78
Stiff Thiophene, diyne linked, D3
 C                 -4.06336900    2.32304100    1.70293700
 C                 -2.69434900    2.15032000    1.86544600
 S                 -2.33641000    1.73750300    3.56164900
 C                 -3.20940600    1.25821500   -1.86544600
 S                 -2.67292700    1.15463800   -3.56164900
 C                 -4.32724000    3.02356300   -2.95463100
 C                 -4.04349600    2.35746000   -1.70293700
 C                 -5.01056200    2.78087700    0.68408600
 C                 -1.60648300    2.31220000    1.01054700
 C                 -2.80566600    0.23515500   -1.01054700
 C                 -4.91359100    2.94883500   -0.68408600
 C                 -0.56697400    2.40578700    0.36534100
 C                 -2.36696000   -0.71188000   -0.36534100
 C                 -0.45486200   -5.25928100   -2.95463100
 C                 -0.01987200   -4.68050100   -1.70293700
 C                  0.51505700   -3.40853500   -1.86544600
 S                  0.33651700   -2.89214200   -3.56164900
 C                 -0.35175200   -4.41947600   -4.02512700
 C                 -0.51505700   -3.40853500    1.86544600
 S                 -0.33651700   -2.89214200    3.56164900
 C                  0.35175200   -4.41947600    4.02512700
 C                  0.45486200   -5.25928100    2.95463100
 C                  0.01987200   -4.68050100    1.70293700
 C                  1.19918300   -2.54735500   -1.01054700
 C                 -1.19918300   -2.54735500    1.01054700
 C                  1.79998600   -1.69390700   -0.36534100
 C                 -1.79998600   -1.69390700    0.36534100
 C                  4.78210200    2.23571800   -2.95463100
 C                  4.06336900    2.32304100   -1.70293700
 C                  2.69434900    2.15032000   -1.86544600
 S                  2.33641000    1.73750300   -3.56164900
 C                  4.00325500    1.90511200   -4.02512700
 C                  3.20940600    1.25821500    1.86544600
 S                  2.67292700    1.15463800    3.56164900
 C                  3.65150300    2.51436400    4.02512700
 C                  4.32724000    3.02356300    2.95463100
 C                  4.04349600    2.35746000    1.70293700
 C                  1.60648300    2.31220000   -1.01054700
 C                  2.80566600    0.23515500    1.01054700
 C                  0.56697400    2.40578700   -0.36534100
 C                  2.36696000   -0.71188000    0.36534100
 C                 -4.78210200    2.23571800    2.95463100
 C                 -5.38532800    3.99314800   -2.72056900
 C                 -5.76605600    3.89671500   -1.41905600
 C                 -6.25768200    3.04519300    1.41905600
 C                 -6.15083200    2.66725700    2.72056900
 C                 -4.00325500    1.90511200    4.02512700
 C                 -3.65150300    2.51436400   -4.02512700
 C                  0.09697100   -5.72971300    0.68408600
 C                  0.76550400   -6.66040500    2.72056900
 C                  0.49162600   -6.94190800    1.41905600
 C                 -0.09697100   -5.72971300   -0.68408600
 C                 -0.49162600   -6.94190800   -1.41905600
 C                 -0.76550400   -6.66040500   -2.72056900
 C                  5.38532800    3.99314800    2.72056900
 C                  5.76605600    3.89671500    1.41905600
 C                  4.91359100    2.94883500    0.68408600
 C                  5.01056200    2.78087700   -0.68408600
 C                  6.25768200    3.04519300   -1.41905600
 C                  6.15083200    2.66725700   -2.72056900
 H                 -0.59953800   -4.60756300   -5.06188000
 H                  0.59953800   -4.60756300    5.06188000
 H                  4.29003500    1.78456600   -5.06188000
 H                  3.69049700    2.82299600    5.06188000
 H                 -5.79792000    4.66676600   -3.46197300
 H                 -6.51615200    4.51332100   -0.93932800
 H                 -7.16672600    3.38649300    0.93932800
 H                 -6.94049800    2.68776300    3.46197300
 H                 -4.29003500    1.78456600    5.06188000
 H                 -3.69049700    2.82299600   -5.06188000
 H                  1.14257800   -7.35452900    3.46197300
 H                  0.65057400   -7.89981400    0.93932800
 H                 -0.65057400   -7.89981400   -0.93932800
 H                 -1.14257800   -7.35452900   -3.46197300
 H                  5.79792000    4.66676600    3.46197300
 H                  6.51615200    4.51332100    0.93932800
 H                  7.16672600    3.38649300   -0.93932800
 H                  6.94049800    2.68776300   -3.46197300
