single point energy calculation
 &qmmm
  qm_theory = 'PM3',
  qmcharge = 0,
  maxcyc = 0,
  qmmm_int = 1,
 /
 6    C 24.732	18.085	19.560
 6    C 25.042	19.385	20.186
 6    C 26.149	19.671	20.974
 6    C 26.436	21.004	21.453
 6    C 25.507	21.965	21.303
 6    C 24.320	21.698	20.659
 6    C 24.108	20.462	20.088
 1    H 26.852	18.847	21.372
 1    H 27.323	21.237	22.021
 1    H 25.650	23.033	21.585
 1    H 23.442	22.379	20.731
 1    H 23.169	20.306	19.522
 6    C 25.625	17.142	19.061
 6    C 27.025	17.551	18.890
 6    C 27.894	16.726	18.208
 6    C 27.524	15.493	17.690
 6    C 26.208	15.122	17.827
 6    C 25.305	15.934	18.464
 1    H 24.283	15.602	18.599
 1    H 27.406	18.542	19.219
 1    H 28.983	16.988	18.312
 1    H 28.312	14.814	17.225
 1    H 25.876	14.070	17.498
 6    C 22.412	17.715	18.576
 6    C 21.055	17.414	18.783
 6    C 20.604	17.116	20.068
 6    C 21.548	17.051	21.139
 6    C 22.893	17.416	21.011
 6    C 23.294	17.676	19.662
 1    H 21.138	16.733	22.053
 1    H 23.613	17.361	21.817
 1    H 20.364	17.433	17.917
 1    H 22.871	18.013	17.572
 7    N 24.686	19.339	16.800
 7    N 25.548	20.051	16.447
 7    N 26.403	20.778	16.120
 1    H 19.513	16.927	20.232
#EXCHARGES
6    C 32.171  29.143   8.566 -0.5503
6    C 33.584  29.395   8.316  0.4917
1    H 31.834  28.678   7.608  0.1904
1    H 31.625  30.081   8.617  0.1904
1    H 32.017  28.412   9.402  0.1904
7    N 34.662  29.649   8.121 -0.5126
#END
