%chk=000209398.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209398

0 1
O 1.762067 0.166020 -1.996156
N -2.085223 0.291626 -0.081713
C 1.695414 -0.036585 -0.562155
C 0.245208 -0.491011 -0.206577
C 2.766218 -1.049464 -0.164719
C 2.044659 1.318391 0.041791
C -0.756671 0.609443 -0.631613
C -0.094260 -1.825897 -0.872576
C 2.652068 -1.824815 0.996743
C 2.403859 2.390661 -0.786024
C 3.909651 -1.173265 -0.968090
C 2.017332 1.493357 1.433414
C 3.664266 -2.725947 1.341058
C 2.727399 3.629945 -0.226598
C 4.918497 -2.075349 -0.623015
C 2.340801 2.734259 1.988069
C 4.796842 -2.855309 0.531742
C 2.695326 3.804541 1.160097
C -3.103469 0.189733 -0.872155
C -4.444871 -0.117667 -0.318773
C -5.492189 -0.414212 -1.209011
C -4.690550 -0.116038 1.063715
C -6.766323 -0.706295 -0.718040
C -5.968299 -0.407589 1.548595
C -7.006813 -0.702890 0.660453
H 0.174245 -0.615633 0.904247
H -0.453332 1.589032 -0.183590
H -0.715766 0.749335 -1.734185
H 0.618953 -2.612958 -0.598822
H -0.109853 -1.751631 -1.965118
H -1.088770 -2.171978 -0.557889
H 1.530954 -0.665832 -2.461595
H 1.776210 -1.732711 1.638294
H 2.429753 2.250263 -1.869732
H 4.007425 -0.550204 -1.860060
H 1.749507 0.664931 2.086964
H 3.569330 -3.326582 2.244057
H 3.005955 4.459446 -0.874030
H 5.802812 -2.166598 -1.251420
H 2.317578 2.866636 3.068282
H 5.583348 -3.557324 0.801485
H 2.947020 4.769697 1.594864
H -3.082136 0.313929 -1.968496
H -5.314525 -0.418758 -2.282898
H -3.875944 0.112669 1.755245
H -7.574518 -0.936495 -1.409943
H -6.153454 -0.404278 2.621524
H -8.001334 -0.929597 1.040052


%chk=000209398-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209398

0 1
O 1.735289 0.012430 -2.061615
N -2.089047 0.235970 0.073671
C 1.711195 -0.094803 -0.579865
C 0.263027 -0.509772 -0.131631
C 2.801019 -1.103158 -0.135385
C 2.077239 1.308161 -0.053033
C -0.763571 0.610394 -0.451673
C -0.188024 -1.844711 -0.769285
C 2.665082 -1.951156 0.992935
C 2.251218 2.400549 -0.936190
C 4.020106 -1.136772 -0.862936
C 2.230132 1.518941 1.340972
C 3.716224 -2.813336 1.380144
C 2.569886 3.682828 -0.432640
C 5.070234 -1.997002 -0.478275
C 2.541622 2.800475 1.843745
C 4.923392 -2.841415 0.646961
C 2.713360 3.890147 0.957841
C -3.118642 0.269372 -0.726850
C -4.486734 -0.077221 -0.283091
C -5.552834 -0.054855 -1.221747
C -4.758802 -0.435862 1.066527
C -6.866458 -0.387250 -0.824266
C -6.069502 -0.766443 1.461987
C -7.128093 -0.744336 0.518704
H 0.264199 -0.623075 0.969957
H -0.453342 1.536727 0.067937
H -0.761200 0.813946 -1.548148
H 0.558455 -2.646479 -0.632310
H -0.380087 -1.723688 -1.853865
H -1.134828 -2.176040 -0.310177
H 1.622316 -0.901085 -2.427525
H 1.738172 -1.954048 1.576395
H 2.138347 2.231982 -2.010043
H 4.136255 -0.473393 -1.726366
H 2.122419 0.680011 2.038296
H 3.589602 -3.462786 2.253838
H 2.704228 4.519564 -1.127934
H 6.004390 -2.005268 -1.051511
H 2.657125 2.947258 2.923647
H 5.737943 -3.509453 0.948467
H 2.959057 4.884681 1.347061
H -3.019375 0.561311 -1.797690
H -5.348330 0.223353 -2.263724
H -3.925663 -0.443295 1.776912
H -7.681960 -0.367714 -1.555740
H -6.273833 -1.040873 2.503156
H -8.146809 -1.001812 0.830061


