%chk=000192782.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192782

0 1
O -3.099164 0.670642 -0.728785
O -0.779578 -1.426313 1.964942
N 4.958820 -0.335038 0.213114
N 1.337612 -0.011313 1.193244
C 3.511146 -0.710939 0.193899
C 2.799201 0.205276 1.217625
C 0.493876 0.586288 0.288668
C -0.897782 0.235691 0.277894
C 5.564634 -0.359386 -1.159049
C 5.728510 -1.196332 1.172953
C -1.727490 0.921915 -0.636545
C -1.279842 1.898602 -1.529891
C -1.452977 -0.786781 1.161573
C 0.964621 1.573833 -0.629562
C -2.907233 -1.018364 1.027893
C 0.097398 2.204259 -1.499279
C -3.658482 -0.286040 0.100472
C 5.039822 0.814943 -1.986324
C 7.033916 -0.501886 1.563387
C -2.198192 2.595504 -2.476170
C -3.578389 -1.969565 1.821034
C -5.044290 -0.464502 -0.065499
C -4.947944 -2.163601 1.674491
C -5.675713 -1.411401 0.733198
H 3.322473 -1.778604 0.429514
H 3.073386 -0.543083 -0.815468
H 3.050182 1.271558 1.006978
H 3.165666 0.001874 2.248506
H 0.966843 -0.758879 1.811300
H 6.668720 -0.260810 -1.047403
H 5.383601 -1.317149 -1.692857
H 5.109825 -1.343564 2.086319
H 5.939744 -2.209571 0.767618
H 2.020523 1.837315 -0.632794
H 0.478117 2.962264 -2.188339
H 3.973055 0.712673 -2.217318
H 5.161691 1.761401 -1.442376
H 5.580999 0.899827 -2.934182
H 7.737912 -0.447608 0.725219
H 6.846121 0.530907 1.888169
H 7.529153 -1.028933 2.385156
H -1.885994 2.448510 -3.518854
H -3.231619 2.225800 -2.393478
H -2.226676 3.676278 -2.280933
H -2.996639 -2.544939 2.548274
H -5.585096 0.128440 -0.798838
H -5.463967 -2.898919 2.288559
H -6.749900 -1.574781 0.630247


%chk=000192782-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192782

0 1
O -3.183580 0.666752 -0.730882
O -0.766212 -1.398337 2.010781
N 5.014811 -0.368520 0.152033
N 1.327273 -0.075329 1.087855
C 3.562738 -0.652991 0.072800
C 2.774364 0.140963 1.152502
C 0.482879 0.558838 0.202126
C -0.936756 0.239184 0.225522
C 5.691109 -0.337318 -1.172663
C 5.716203 -1.223902 1.148369
C -1.794681 0.922991 -0.694333
C -1.349701 1.888882 -1.621044
C -1.487674 -0.747628 1.155749
C 0.941191 1.531993 -0.736458
C -2.948713 -0.982154 1.081756
C 0.039758 2.167369 -1.607557
C -3.742715 -0.270876 0.146101
C 5.357778 0.927609 -1.986874
C 6.979601 -0.561118 1.730040
C -2.310560 2.579904 -2.566659
C -3.588629 -1.916886 1.938035
C -5.137065 -0.470919 0.049956
C -4.975211 -2.128966 1.856546
C -5.748507 -1.402711 0.909217
H 3.334842 -1.740671 0.181647
H 3.186684 -0.353767 -0.921502
H 3.022758 1.213495 1.046363
H 3.116297 -0.164645 2.158002
H 0.855642 -0.762328 1.707651
H 6.781471 -0.358817 -0.992715
H 5.452403 -1.249733 -1.776222
H 5.010988 -1.423843 1.976928
H 5.977564 -2.221791 0.712956
H 2.001383 1.794544 -0.778395
H 0.424746 2.913766 -2.312895
H 4.278877 0.996972 -2.218773
H 5.645306 1.830287 -1.420024
H 5.903617 0.922717 -2.948891
H 7.733944 -0.354779 0.949274
H 6.718210 0.397827 2.210132
H 7.450395 -1.220419 2.483128
H -1.773014 3.298778 -3.208373
H -2.831185 1.855419 -3.219821
H -3.096753 3.129415 -2.016613
H -2.959901 -2.455792 2.653958
H -5.709537 0.100059 -0.686699
H -5.462240 -2.851105 2.519653
H -6.829594 -1.566918 0.844616


