%chk=000212908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212908

0 1
O 1.305716 1.456084 0.165990
O -0.201897 1.778408 -2.137401
O 2.233036 0.728660 2.131042
N 3.533348 1.681560 0.419665
C -0.760778 0.227832 -0.263055
C -0.045780 1.229322 0.676014
C -0.512192 -1.241343 0.073561
C -2.247898 0.549445 -0.115302
C -0.242274 0.410174 -1.722715
C -1.198772 -2.218042 -0.673343
C -2.874872 1.472671 -0.963564
C 0.369199 -1.653316 1.078733
C -2.990644 -0.048545 0.915984
C -0.992496 -3.575094 -0.425572
C -4.229567 1.774587 -0.798941
C 0.573490 -3.015731 1.326370
C -4.343672 0.257323 1.079544
C -0.101400 -3.979627 0.575350
C -4.968134 1.167312 0.220499
C 2.370757 1.205593 1.023787
C 4.839116 1.170774 0.914452
C 5.273201 -0.137730 0.237625
C 5.656840 0.046292 -1.226274
H -0.501320 2.237183 0.620708
H -0.013526 0.887543 1.727180
H -0.929392 -0.051280 -2.456220
H 0.769384 -0.023884 -1.821822
H -1.909847 -1.914007 -1.441443
H -2.302834 1.968084 -1.756303
H 0.908194 -0.923477 1.691453
H -2.516020 -0.760958 1.591639
H 0.480504 2.269857 -1.623453
H -1.528810 -4.320977 -1.009970
H -4.707985 2.488343 -1.467696
H 1.263011 -3.319748 2.113027
H -4.912192 -0.214856 1.878932
H 0.059664 -5.037981 0.768167
H -6.022656 1.402883 0.347165
H 3.493529 1.905542 -0.576186
H 5.588609 1.976462 0.740284
H 4.770710 1.024855 2.019979
H 4.468199 -0.895992 0.327019
H 6.133267 -0.558301 0.798950
H 6.444116 0.799102 -1.350915
H 6.035634 -0.891135 -1.653636
H 4.803534 0.353631 -1.840809


%chk=000212908-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212908

0 1
O 1.330743 1.376914 -0.109045
O -0.377311 1.883609 -2.316957
O 2.239781 1.014226 2.045904
N 3.586001 1.494182 0.180441
C -0.879278 0.234485 -0.426368
C -0.060225 1.245952 0.421876
C -0.556805 -1.245503 -0.133128
C -2.361255 0.555805 -0.098105
C -0.537681 0.472421 -1.948423
C -1.273389 -2.245729 -0.847595
C -3.081740 1.532178 -0.836843
C 0.429068 -1.665404 0.794911
C -2.999133 -0.064188 1.008201
C -1.008557 -3.616751 -0.650905
C -4.414281 1.853809 -0.493831
C 0.692783 -3.041051 0.997548
C -4.328430 0.263772 1.355378
C -0.018592 -4.023193 0.274784
C -5.044535 1.222389 0.602771
C 2.394798 1.271710 0.823966
C 4.879419 1.385845 0.878290
C 5.552709 0.000738 0.726229
C 5.911357 -0.354694 -0.732055
H -0.509768 2.247255 0.325650
H -0.013275 0.969654 1.487938
H -1.358779 0.098956 -2.581198
H 0.383431 -0.091477 -2.189709
H -2.064531 -1.947311 -1.546015
H -2.592178 2.047376 -1.670287
H 0.995350 -0.935016 1.381796
H -2.459278 -0.819459 1.590724
H 0.469673 2.197323 -1.905235
H -1.578424 -4.366529 -1.211448
H -4.957591 2.603833 -1.080240
H 1.454463 -3.340378 1.726691
H -4.803936 -0.229919 2.210626
H 0.187484 -5.087572 0.434232
H -6.077337 1.474939 0.868562
H 3.558958 1.660953 -0.825591
H 5.549324 2.175922 0.487632
H 4.689818 1.595038 1.945120
H 4.882417 -0.769668 1.152461
H 6.470934 0.003401 1.346670
H 6.585108 0.403478 -1.175675
H 6.424427 -1.331366 -0.787111
H 5.006363 -0.423458 -1.364139


