%chk=000201519.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201519

0 1
O -1.223835 3.182682 -1.691531
N -0.500552 1.224442 -0.856396
C -0.030606 0.287911 0.202498
C -0.997744 -0.950702 0.247177
C 1.410410 -0.196688 -0.213649
C 0.035312 0.981088 1.589724
C -2.426490 -0.577958 0.692948
C -1.059860 -1.712250 -1.092104
C 2.390469 0.978570 -0.399219
C 1.990442 -1.207471 0.796517
C -0.944533 2.141749 1.774203
C -3.471730 -1.627421 0.275796
C -1.758049 -3.071259 -0.920505
C 3.772475 0.483264 -0.846464
C 3.362441 -1.717395 0.333244
C -2.868659 -3.030635 0.142770
C 4.344027 -0.555529 0.127775
C -0.760419 3.181566 0.671498
C -0.858236 2.561262 -0.701684
H -0.573499 -1.653016 1.011335
H 1.314400 -0.720130 -1.200915
H 1.066677 1.366504 1.752726
H -0.124335 0.227640 2.384147
H -2.716726 0.402074 0.265688
H -2.444078 -0.453688 1.791389
H -0.042821 -1.864102 -1.504423
H -1.610504 -1.109426 -1.840176
H 2.479861 1.545969 0.548573
H 1.996140 1.694058 -1.145945
H 1.296977 -2.061477 0.924002
H 2.091892 -0.740832 1.794065
H -0.600335 0.826180 -1.792521
H -0.788690 2.610175 2.765770
H -1.990983 1.776864 1.775841
H -3.926334 -1.332574 -0.690525
H -4.299684 -1.639998 1.008309
H -1.016842 -3.845365 -0.647896
H -2.180325 -3.385881 -1.893584
H 4.465809 1.340879 -0.932812
H 3.702718 0.045825 -1.861114
H 3.254571 -2.288210 -0.608866
H 3.768651 -2.428459 1.076415
H -2.463754 -3.352855 1.121027
H -3.660441 -3.758943 -0.112234
H 5.309618 -0.938274 -0.251326
H 4.564914 -0.075258 1.100051
H 0.222195 3.690229 0.761711
H -1.517132 3.990164 0.753290


%chk=000201519-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201519

0 1
O -1.044528 3.273731 -1.753778
N -0.531087 1.225647 -0.804599
C -0.053626 0.265096 0.234505
C -1.035976 -0.976553 0.235808
C 1.417086 -0.173522 -0.168803
C -0.047070 0.946029 1.646802
C -2.491829 -0.593351 0.651588
C -1.106903 -1.767586 -1.098394
C 2.395081 1.023049 -0.333932
C 2.040904 -1.235347 0.778100
C -0.958633 2.187084 1.778236
C -3.542207 -1.665491 0.231361
C -1.800902 -3.146190 -0.881813
C 3.775921 0.556688 -0.854849
C 3.434960 -1.694485 0.281637
C -2.918453 -3.078041 0.200728
C 4.399615 -0.502693 0.082230
C -0.631568 3.207404 0.669447
C -0.748847 2.591394 -0.722333
H -0.638434 -1.672032 1.003202
H 1.344178 -0.641017 -1.175919
H 0.982476 1.265560 1.891484
H -0.322852 0.188647 2.403262
H -2.756474 0.372767 0.181357
H -2.535182 -0.445620 1.747963
H -0.106282 -1.938678 -1.535033
H -1.682155 -1.177678 -1.841647
H 2.545020 1.534317 0.639777
H 1.964552 1.769395 -1.027130
H 1.382303 -2.120251 0.863611
H 2.140559 -0.809481 1.797778
H -0.619613 0.849565 -1.754944
H -0.807948 2.647321 2.773499
H -2.023986 1.903107 1.714056
H -3.939443 -1.430276 -0.776108
H -4.407045 -1.631764 0.920923
H -1.045058 -3.900443 -0.587406
H -2.229626 -3.488698 -1.843372
H 4.452025 1.427563 -0.956092
H 3.658466 0.124197 -1.870311
H 3.316613 -2.228738 -0.684265
H 3.865522 -2.422492 0.996805
H -2.498933 -3.309435 1.200239
H -3.690135 -3.845267 0.000838
H 5.367007 -0.857397 -0.323312
H 4.615378 -0.036925 1.066347
H 0.401616 3.590755 0.792953
H -1.301685 4.083435 0.694106


