 RESP-A1 project. RESP input generated by R.E.D.
 &cntrl
  ioutopt=1, iqopt=1, nmol=2, ihfree=1, irstrnt=1, qwt= 0.0005 
 &end 
  1.0
 Trans_N-Methylacetamide 
    0   12          Column not used by RESP (Added by R.E.D. for information)
    6    0                         1
    1    0                         2
    1    0                         3
    1    0                         4
    6    0                         5
    8    0                         6
    7    0                         7
    1    0                         8
    6    0                         9
    1    0                        10
    1    0                        11
    1    0                        12

  1.0
 Trans_N-Methylacetamide
    0   12
    6    0                         1
    1    0                         2
    1    0                         3
    1    0                         4
    6    0                         5
    8    0                         6
    7    0                         7
    1    0                         8
    6    0                         9
    1    0                        10
    1    0                        11
    1    0                        12

                    Inter-'molecular' charge equivalencing (i.e. for orientations, conformations or different molecules)
    2
    1    1    2    1
    2
    1    2    2    2
    2
    1    3    2    3
    2
    1    4    2    4
    2
    1    5    2    5
    2
    1    6    2    6
    2
    1    7    2    7
    2
    1    8    2    8
    2
    1    9    2    9
    2
    1   10    2   10
    2
    1   11    2   11
    2
    1   12    2   12






