%chk=000212264.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212264

0 1
O 6.584877 -0.318495 -0.115641
O 0.063690 -0.046419 0.476394
O -2.882475 -1.344458 -0.290652
O 0.037144 0.143525 -1.776700
O -5.482562 -0.000980 0.057982
N 3.778336 -0.092663 0.359681
C 4.301923 -0.542549 -0.972924
C 4.745579 0.864420 0.990705
C 2.419615 0.518963 0.221877
C 5.662523 -1.223147 -0.757833
C 6.096330 0.148553 1.157813
C 1.407733 -0.615593 0.433711
C -0.533306 0.287524 -0.724224
C -1.882362 0.862930 -0.461822
C -3.001413 0.039747 -0.252258
C -2.020500 2.254907 -0.483977
C -4.278760 0.631718 -0.110350
C -3.283174 2.832958 -0.306217
C -4.409959 2.035491 -0.130307
C -2.352460 -1.923299 0.935918
C -5.543783 -1.439670 -0.126115
H 3.579896 -1.264576 -1.410632
H 4.409124 0.291794 -1.699968
H 4.884275 1.794351 0.398457
H 4.351142 1.157903 1.986715
H 2.241368 1.007693 -0.761930
H 2.254146 1.304118 0.990641
H 5.572179 -2.137729 -0.145859
H 6.173604 -1.445747 -1.710745
H 6.896158 0.837158 1.481242
H 6.021480 -0.708460 1.850313
H 1.489064 -1.078477 1.433535
H 1.452655 -1.382125 -0.357920
H -1.149210 2.888575 -0.645904
H -3.386042 3.918837 -0.316037
H -5.402164 2.471006 -0.008377
H -2.268955 -2.982276 0.668761
H -1.370781 -1.493108 1.171263
H -3.058099 -1.765060 1.755039
H -6.624418 -1.606899 -0.205932
H -5.017059 -1.741657 -1.038600
H -5.119958 -1.934281 0.751480


%chk=000212264-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212264

0 1
O 6.697977 -0.093402 -0.057084
O 0.055957 -0.378709 0.094719
O -2.578673 -1.283161 0.321157
O 0.269914 0.678345 -1.970853
O -5.168541 -0.154639 0.716137
N 3.828993 -0.213066 0.369822
C 4.396893 0.067612 -0.976479
C 4.742171 0.290346 1.427406
C 2.428335 0.240995 0.518825
C 5.783066 -0.583899 -1.102746
C 6.124012 -0.366913 1.271006
C 1.471469 -0.838074 -0.022817
C -0.437763 0.361466 -0.981104
C -1.856428 0.796379 -0.790633
C -2.845041 0.028979 -0.114479
C -2.203122 2.063598 -1.333244
C -4.163719 0.556596 0.024707
C -3.497678 2.589535 -1.160758
C -4.478757 1.836374 -0.477354
C -2.425328 -1.429555 1.787825
C -5.616897 -1.411066 0.067197
H 3.726087 -0.337600 -1.755718
H 4.490903 1.168603 -1.150398
H 4.861177 1.401852 1.378533
H 4.324729 0.032263 2.418960
H 2.233301 1.205219 -0.005913
H 2.215082 0.398729 1.591983
H 5.683176 -1.688038 -1.025302
H 6.261744 -0.319264 -2.059926
H 6.846101 0.045599 1.995057
H 6.029009 -1.464500 1.419258
H 1.521417 -1.752037 0.587338
H 1.684703 -1.069161 -1.080256
H -1.434879 2.620071 -1.879041
H -3.747420 3.576245 -1.563460
H -5.497162 2.211840 -0.334857
H -2.309904 -2.510065 1.962933
H -1.517514 -0.894023 2.116780
H -3.322037 -1.048769 2.310309
H -6.354198 -1.847131 0.758174
H -6.098691 -1.183880 -0.902833
H -4.767064 -2.099189 -0.082271


