%chk=000218258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218258

0 1
O 1.870627 -0.264497 -0.035933
N -5.913582 0.448881 -0.066676
N -4.469686 -1.153055 -0.743830
C -2.281504 -0.076322 -0.171667
C -3.739608 -0.073887 -0.226177
C 0.504078 -0.096136 -0.061756
C -1.572080 1.108546 0.068840
C -1.569583 -1.283370 -0.364778
C -4.626982 0.930333 0.200634
C 2.696242 0.913505 0.217406
C -0.173694 1.112366 0.128548
C -0.184088 -1.303768 -0.310391
C 4.118368 0.428426 0.144488
C -5.778602 -0.824352 -0.642408
C -7.159917 1.164812 0.213899
C 5.122909 1.165095 0.790550
C 4.448567 -0.728121 -0.574248
C 6.452513 0.743693 0.709734
C 5.780064 -1.147014 -0.645641
C 6.783184 -0.411576 -0.006948
H -2.107227 2.047222 0.208438
H -2.125523 -2.205476 -0.561408
H -4.431473 1.881356 0.650253
H 2.434486 1.309457 1.215630
H 2.486772 1.665283 -0.567351
H 0.351996 2.040724 0.316254
H 0.380693 -2.221995 -0.453447
H -6.607514 -1.438710 -0.954156
H -7.201261 2.118885 -0.344273
H -8.037785 0.562712 -0.078754
H -7.249561 1.393220 1.292487
H 4.873274 2.061030 1.354535
H 3.658405 -1.299751 -1.065872
H 7.232968 1.315611 1.208756
H 6.034514 -2.048444 -1.201029
H 7.819612 -0.737783 -0.065609


%chk=000218258-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218258

0 1
O 1.887390 -0.415913 -0.022928
N -5.992615 0.518271 -0.094730
N -4.577884 -1.212017 -0.472945
C -2.351846 -0.098728 -0.105469
C -3.822095 -0.059686 -0.153606
C 0.492257 -0.236186 -0.031554
C -1.574669 1.039933 0.226446
C -1.669710 -1.314312 -0.398163
C -4.695388 1.015437 0.081834
C 2.718422 0.753835 0.284583
C -0.164815 0.983730 0.266967
C -0.268331 -1.385456 -0.362525
C 4.180808 0.364938 0.164829
C -5.864715 -0.828859 -0.428310
C -7.241379 1.275453 0.043405
C 5.160276 1.140924 0.833572
C 4.591757 -0.729493 -0.633521
C 6.532977 0.837152 0.696267
C 5.964913 -1.037615 -0.764864
C 6.940199 -0.254632 -0.105189
H -2.068112 1.990694 0.460471
H -2.269244 -2.193761 -0.652051
H -4.516551 2.053405 0.349297
H 2.495616 1.119369 1.308790
H 2.475112 1.569348 -0.431582
H 0.398005 1.883494 0.531961
H 0.259239 -2.318014 -0.585218
H -6.724221 -1.466762 -0.622993
H -7.279561 2.108395 -0.680635
H -8.093560 0.604491 -0.151342
H -7.343934 1.683357 1.064413
H 4.852341 1.983672 1.466080
H 3.830967 -1.337175 -1.131500
H 7.280738 1.444495 1.218624
H 6.272990 -1.889816 -1.381289
H 8.004228 -0.495068 -0.209029


