%chk=000211047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211047

0 1
O -3.487969 2.118077 0.468614
O 3.485223 2.129024 -0.437294
O -3.666283 -2.050861 -1.609217
O 3.668512 -2.070233 1.578064
N -2.002868 -0.419351 -1.509712
N 2.003185 -0.439307 1.503164
N -4.002192 0.013078 -0.452977
N 4.001979 0.011148 0.452862
C -0.705296 0.791463 0.303452
C 0.704157 0.796683 -0.291943
C -1.782821 0.857195 -0.785435
C 1.781606 0.847552 0.797811
C -3.173460 1.139777 -0.153973
C 3.171897 1.141188 0.170659
C -3.272306 -0.976158 -1.232887
C 3.273265 -0.990477 1.217891
C -5.392725 -0.127676 -0.075735
C 5.392701 -0.122310 0.073666
C -6.125627 1.009447 0.306025
C 6.124327 1.021232 -0.290996
C -5.994748 -1.397734 -0.087704
C 5.996180 -1.391709 0.066729
C -7.463760 0.863518 0.677744
C 7.462655 0.882403 -0.664732
C -7.335007 -1.518995 0.283879
C 7.336604 -1.505873 -0.306504
C -8.072757 -0.394880 0.668159
C 8.073092 -0.375300 -0.673890
H -0.835826 1.667163 0.981515
H -0.857613 -0.100537 0.943844
H 0.857497 -0.085569 -0.945458
H 0.833664 1.682469 -0.956977
H -1.549506 1.665860 -1.530707
H 1.547311 1.644782 1.555011
H -1.221626 -0.994209 -1.800458
H 1.222521 -1.019642 1.784513
H -5.663448 1.999254 0.325527
H 5.661024 2.010695 -0.295746
H -5.435731 -2.285834 -0.395294
H 5.438156 -2.284934 0.360987
H -8.034509 1.743030 0.976695
H 8.032419 1.766934 -0.950457
H -7.806171 -2.502221 0.272331
H 7.808896 -2.488621 -0.309590
H -9.116430 -0.499226 0.957593
H 9.116906 -0.474116 -0.964752


%chk=000211047-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211047

0 1
O -3.501320 2.005320 0.801898
O 3.499109 2.020491 -0.772402
O -3.772294 -1.783429 -2.036768
O 3.770930 -1.813617 2.004867
N -2.041878 -0.256649 -1.519208
N 2.039402 -0.281126 1.509105
N -4.041064 0.060177 -0.488780
N 4.039849 0.055093 0.486992
C -0.700241 0.868004 0.329981
C 0.698146 0.874333 -0.321247
C -1.840891 0.949958 -0.712477
C 1.838413 0.938824 0.722788
C -3.215693 1.108316 -0.027857
C 3.213592 1.109422 0.041957
C -3.320753 -0.785936 -1.431844
C 3.319087 -0.807231 1.415057
C -5.412006 -0.161341 -0.096215
C 5.412093 -0.157598 0.093856
C -6.228134 0.945812 0.248698
C 6.225754 0.956137 -0.235535
C -5.935495 -1.477978 -0.047594
C 5.939615 -1.471993 0.029714
C -7.565109 0.728214 0.642779
C 7.564208 0.747367 -0.629391
C -7.277672 -1.676755 0.339850
C 7.283214 -1.661941 -0.357251
C -8.098040 -0.580084 0.688838
C 8.101167 -0.558643 -0.690591
H -0.815543 1.741208 1.001467
H -0.847723 -0.044235 0.940516
H 0.846458 -0.026855 -0.947785
H 0.812852 1.759370 -0.977132
H -1.672104 1.837373 -1.357662
H 1.669097 1.815078 1.382978
H -1.367491 -0.644158 -2.175845
H 1.364851 -0.679849 2.158828
H -5.819206 1.957839 0.226498
H 5.813865 1.966621 -0.201714
H -5.311917 -2.328222 -0.330421
H 5.318070 -2.327560 0.300612
H -8.190061 1.586739 0.911380
H 8.187139 1.611033 -0.885947
H -7.679645 -2.695227 0.369957
H 7.688199 -2.678801 -0.399234
H -9.137811 -0.742799 0.992257
H 9.142081 -0.714502 -0.993678


