%chk=000183845.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183845

0 1
O 2.279012 3.292960 0.496066
O -2.784985 -1.555851 0.390919
N -1.877561 0.545481 0.003934
N -4.253516 0.226148 0.291258
C 3.753383 -0.694419 0.012220
C 2.272954 -0.362307 0.019631
C 1.811414 0.962676 -0.068761
C 1.325771 -1.397354 0.103066
C 4.144569 -1.316181 -1.334490
C 4.125881 -1.615115 1.181087
C 0.439449 1.240098 -0.061619
C -0.491822 0.189420 0.030216
C -0.041887 -1.140205 0.112783
C 2.761491 2.129007 -0.191429
C -2.949573 -0.359655 0.206357
C -5.368652 -0.759056 0.258348
C -4.544754 1.475354 -0.455421
H 4.342257 0.256327 0.137958
H 1.668044 -2.431991 0.163657
H 3.626203 -2.266266 -1.507831
H 5.219912 -1.516282 -1.383089
H 3.888166 -0.652839 -2.168045
H 3.776661 -1.205053 2.135637
H 5.211003 -1.745895 1.250238
H 3.685716 -2.613026 1.075947
H 0.116911 2.279445 -0.132454
H -0.759275 -1.965477 0.187845
H 3.777025 1.889183 0.189148
H 2.838058 2.478234 -1.241705
H -2.074864 1.547817 -0.031620
H 2.088965 3.075663 1.432629
H -6.222387 -0.345416 0.818936
H -5.691788 -1.018571 -0.761069
H -5.056233 -1.696458 0.762299
H -4.375191 1.388266 -1.541207
H -5.598431 1.766262 -0.298707
H -3.929924 2.302075 -0.059731


%chk=000183845-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183845

0 1
O 2.071566 3.325221 0.530854
O -2.909954 -1.744512 -0.047047
N -1.926358 0.398850 -0.022811
N -4.274595 0.160082 0.001872
C 3.790410 -0.708245 -0.234956
C 2.281222 -0.422685 -0.192492
C 1.775862 0.908518 -0.081664
C 1.337344 -1.478848 -0.221779
C 4.168478 -1.893790 -1.157694
C 4.340769 -0.948424 1.200711
C 0.383002 1.133370 -0.029916
C -0.545030 0.059884 -0.068480
C -0.055038 -1.267584 -0.158081
C 2.709758 2.119799 -0.022763
C -3.024848 -0.478093 -0.024630
C -5.483742 -0.677778 0.022019
C -4.439782 1.620362 0.010683
H 4.303085 0.184763 -0.644788
H 1.693968 -2.511728 -0.301633
H 3.799300 -2.856296 -0.758396
H 5.268292 -1.974492 -1.240322
H 3.752468 -1.763316 -2.172791
H 4.125633 -0.093736 1.868675
H 5.435778 -1.105318 1.181739
H 3.871223 -1.845392 1.645443
H 0.028585 2.171338 0.021972
H -0.761141 -2.098897 -0.180839
H 3.626246 1.879499 0.553168
H 3.021971 2.430537 -1.036216
H -2.114971 1.401047 0.013801
H 1.768005 3.122198 1.452592
H -6.081054 -0.491763 0.935590
H -6.116623 -0.482583 -0.865187
H -5.166220 -1.731420 0.010015
H -3.992408 2.099487 -0.884504
H -5.515449 1.857148 -0.001175
H -4.013750 2.089796 0.922031


