%chk=000291456.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291456

0 1
O 1.332058 -2.468139 1.121047
O 3.279151 -0.526754 -2.772974
O -1.509215 2.922788 -0.043134
O -3.589209 2.436968 -0.337462
O 1.352255 -1.372365 -2.026524
N -4.423615 -0.024534 -0.207314
N -2.419182 2.111400 -0.111475
C -0.381402 -0.940666 0.541368
C 2.072222 -0.264713 0.668024
C -3.116138 -0.322917 0.035836
C -2.118018 0.711893 0.084690
C 1.019679 -1.344765 0.791543
C -0.763854 0.369849 0.325110
C -1.370049 -1.969954 0.495531
C -2.687660 -1.677078 0.255723
C 2.706997 0.024516 -0.551282
C 2.434171 0.433968 1.824779
C 3.703855 1.012609 -0.601848
C 3.423336 1.421393 1.766940
C 4.057341 1.711007 0.554793
C 2.330154 -0.701555 -1.787139
C -5.488840 -1.042309 -0.274660
H -0.024568 1.185822 0.340100
H -1.041160 -3.005132 0.657142
H -3.421015 -2.479827 0.221627
H 1.950464 0.202869 2.775233
H -4.713740 0.958359 -0.368560
H 4.201202 1.226993 -1.553201
H 3.700733 1.964518 2.671743
H 4.829138 2.479781 0.511001
H -5.302902 -1.774595 -1.082439
H -6.456898 -0.552457 -0.481896
H -5.587938 -1.592850 0.679126
H 3.041146 -1.012022 -3.610248


%chk=000291456-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291456

0 1
O 1.289117 -2.411181 1.535093
O 2.678189 0.047157 -2.894857
O -1.429797 2.907960 -0.476339
O -3.620143 2.365088 -0.780492
O 1.341095 -1.491157 -1.790134
N -4.434475 -0.086905 -0.360557
N -2.383774 2.037482 -0.463739
C -0.375960 -0.948436 0.596679
C 2.130559 -0.286605 0.778310
C -3.128427 -0.356036 -0.050782
C -2.093678 0.659305 -0.094190
C 1.021524 -1.309581 0.965528
C -0.749334 0.352094 0.221864
C -1.387543 -1.959439 0.656141
C -2.712443 -1.677312 0.341388
C 2.646231 0.118285 -0.489130
C 2.696838 0.264422 1.953044
C 3.686252 1.082365 -0.557535
C 3.728450 1.225837 1.878555
C 4.219604 1.642606 0.619513
C 2.143059 -0.526854 -1.731714
C -5.512446 -1.075734 -0.326051
H -0.020523 1.166161 0.172475
H -1.082408 -2.968125 0.953698
H -3.460032 -2.473633 0.386052
H 2.322064 -0.066806 2.926839
H -4.615615 0.894684 -0.629381
H 4.068782 1.370997 -1.539929
H 4.147025 1.645713 2.799515
H 5.018846 2.388304 0.558033
H -5.329400 -1.909039 -1.031659
H -6.451538 -0.580390 -0.617707
H -5.647866 -1.501478 0.686944
H 2.316265 -0.437644 -3.684275


