%chk=000101044.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000101044

0 1
O 1.006353 -0.719609 -1.707979
N 1.446907 -1.047405 0.496770
C -0.858740 -0.301114 -0.179166
C -1.513243 -1.530536 0.548221
C -0.851909 0.904904 0.792603
C -0.322887 2.279638 0.318414
C -1.601118 0.017229 -1.479324
C 0.595943 -0.679415 -0.558433
C -1.344343 -2.821190 -0.260680
C -2.997764 -1.293659 0.852939
C 1.035716 2.224177 -0.381764
C -1.339575 3.028368 -0.553909
C 2.904718 -1.200172 0.265437
C 3.686359 -0.019616 0.840772
H -0.986222 -1.667189 1.526329
H -1.900050 1.054903 1.136642
H -0.288419 0.625966 1.704558
H -0.189129 2.884413 1.257098
H -2.639563 0.304696 -1.293486
H -1.596818 -0.844735 -2.160001
H -1.113741 0.842281 -2.021370
H -1.767369 -2.728431 -1.268596
H -0.289227 -3.096521 -0.380728
H -1.845397 -3.663753 0.227337
H -3.603793 -1.294055 -0.060658
H -3.161384 -0.332531 1.354970
H -3.394282 -2.080591 1.503674
H 0.980634 1.705586 -1.350190
H 1.413599 3.231511 -0.587281
H 1.796001 1.705855 0.220460
H -1.433933 2.566285 -1.546230
H -2.335229 3.039820 -0.101312
H -1.033634 4.068111 -0.710705
H 1.167524 -0.901881 1.460209
H 3.234711 -2.155980 0.728321
H 3.086544 -1.288390 -0.834988
H 3.253916 0.940517 0.508016
H 3.690744 -0.016966 1.935216
H 4.729901 -0.038620 0.506510


%chk=000101044-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101044

0 1
O 1.043012 -0.724066 -1.790697
N 1.479402 -0.922025 0.475799
C -0.833400 -0.256651 -0.217167
C -1.466408 -1.505070 0.549610
C -0.864468 0.977410 0.758253
C -0.442264 2.410767 0.292936
C -1.603968 0.016543 -1.529854
C 0.636219 -0.635804 -0.590429
C -1.194185 -2.855591 -0.160301
C -2.991067 -1.366213 0.793789
C 0.932716 2.485054 -0.413728
C -1.526457 3.152337 -0.532409
C 2.880568 -1.341117 0.298310
C 3.889755 -0.319308 0.862815
H -0.978070 -1.547878 1.549354
H -1.899279 1.066337 1.143523
H -0.243387 0.726160 1.645506
H -0.345491 2.981301 1.243543
H -2.597757 0.446746 -1.318131
H -1.734129 -0.910420 -2.113690
H -1.043759 0.711180 -2.174481
H -1.669727 -2.885950 -1.157406
H -0.115916 -3.047632 -0.295655
H -1.616430 -3.686760 0.434774
H -3.548468 -1.397890 -0.159683
H -3.262072 -0.432917 1.317913
H -3.347265 -2.210150 1.413717
H 0.921809 1.969705 -1.390405
H 1.211117 3.540901 -0.592031
H 1.727381 2.022166 0.199809
H -1.624501 2.744009 -1.552070
H -2.517150 3.089858 -0.043015
H -1.264021 4.223232 -0.626522
H 1.119875 -0.834691 1.427436
H 3.032937 -2.329313 0.776791
H 3.023770 -1.465830 -0.788514
H 3.787191 0.652314 0.348995
H 3.742396 -0.156517 1.947318
H 4.923293 -0.682328 0.713694


