2   C41  324.34  {H1, H2, H3}  30.920  {P4, 1.0000}
 1   C16  171.47  {H1}  13.629  {P1, 1.0000}
 1   C13  100.49  {H1, H3}  18.538  {P5, 1.0000}
 4   C05  100.49  {H1, H3}  13.877  {P1, 1.0000}
 1   C06  100.49  {H1, H3}  21.292  {P1, 1.0000}
 2   C02  100.49  {H1}  26.284  {P1, 1.0000}
 2   C06  100.49  {H1, H3}  21.292  {P5, 1.0000}
 1   C29  100.49  {H1}  14.576  {P1, 1.0000}
 3   C02  100.49  {H1}  26.284  {P3, 1.0000}
 2   C19  324.34  {H1, H3}  22.667  {P1, 1.0000}
 3   C06  100.49  {H1, H3}  21.292  {P2, 1.0000}
 2   C12  100.49  {H1, H3}  19.193  {P1, 1.0000}
 1   C04  324.34  {H1, H3}  24.246  {P2, 1.0000}
 1   C22  100.49  {H2}  17.570  {P1, 1.0000}
 2   C07  100.49  {H1}  25.524  {P1, 1.0000}
 1   C13  100.49  {H1, H3}  18.538  {P1, 1.0000}
 1   C10  100.49  {H1}  13.643  {P1, 1.0000}
 1   C38  100.49  {H3}  12.125  {P5, 1.0000}
 1   C24  324.34  {H1, H3}  20.768  {P1, 1.0000}
 1   C14  100.49  {H1, H3}  16.500  {P2, 1.0000}
 1   C02  100.49  {H1}  26.284  {P2, 1.0000}
 1   C14  100.49  {H1, H3}  16.500  {P1, 1.0000}
 4   C01  100.49  {H1}  25.078  {P1, 1.0000}
 3   C08  150.38  {H1}  22.521  {P1, 1.0000}
 1   C05  100.49  {H1, H3}  13.877  {P2, 1.0000}
 2   C10  100.49  {H1}  13.643  {P4, 1.0000}
 1   C21  100.49  {H1, H3}  15.722  {P2, 1.0000}