%chk=000253644.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253644

0 1
O 0.279230 1.729739 -0.314137
O 0.670602 0.046787 2.328254
O 0.886661 -1.468633 -0.873677
O 3.805940 0.860316 -0.381470
O -0.076178 -1.927533 3.150385
O 2.912000 -2.473538 -0.767260
O 3.665400 0.428530 -2.596337
N -1.816103 0.684066 -0.199021
N -3.147983 -0.179846 -1.871874
N -3.550119 2.108407 0.933262
N -5.733590 1.937089 -0.160208
C 0.128470 -0.263810 1.028045
C 1.307542 -0.428346 0.048974
C -0.603898 1.027007 0.567752
C 1.384129 0.887150 -0.754031
C 2.641123 1.716212 -0.452981
C -3.092967 1.241555 -0.018909
C -1.916554 -0.159244 -1.359512
C -3.920810 0.681832 -1.068057
C 0.498522 -0.890612 3.353267
C 1.795002 -2.465113 -1.221494
C -5.273854 1.076326 -1.092366
C 4.237927 0.241931 -1.549883
C 1.125030 -0.341623 4.579464
C 1.132432 -3.388229 -2.172830
C -4.866847 2.414025 0.804260
C 5.395665 -0.624537 -1.226255
H -0.519558 -1.172555 1.079248
H 2.266494 -0.707726 0.546225
H -0.849385 1.748216 1.389725
H 1.241501 0.721793 -1.847288
H 2.802373 2.497807 -1.217157
H 2.615153 2.165508 0.558889
H -1.049149 -0.706308 -1.724851
H -5.975268 0.704596 -1.850044
H 0.376285 -0.219201 5.381085
H 1.900878 -1.025268 4.964318
H 1.598266 0.641809 4.414394
H 0.043025 -3.227841 -2.243755
H 1.297852 -4.440038 -1.882952
H 1.545371 -3.264489 -3.190168
H -5.296005 3.113597 1.541149
H 5.038302 -1.651148 -0.994691
H 5.955080 -0.279465 -0.343013
H 6.091315 -0.700895 -2.075175


%chk=000253644-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253644

0 1
O 0.184775 1.431746 -0.757869
O 0.546484 0.229591 2.214260
O 0.642936 -1.691866 -0.941093
O 3.784602 0.682919 0.080364
O 0.658722 -1.960226 3.013176
O 2.836847 -2.398697 -1.298237
O 4.270528 1.001217 -2.178663
N -2.013668 0.563751 -0.336862
N -3.578474 -0.393942 -1.731468
N -3.437214 2.293351 0.724392
N -5.750827 2.241147 -0.103669
C -0.001548 -0.294637 0.938520
C 1.160573 -0.651663 -0.010734
C -0.729275 0.903261 0.274960
C 1.454229 0.658097 -0.767655
C 2.558091 1.503867 -0.095739
C -3.207857 1.263825 -0.123353
C -2.302160 -0.409071 -1.318133
C -4.173293 0.654049 -0.991117
C 0.846032 -0.742044 3.202790
C 1.617649 -2.530327 -1.529804
C -5.475551 1.195017 -0.942349
C 4.550316 0.462159 -1.086310
C 1.404290 -0.073583 4.433965
C 0.962565 -3.542273 -2.436688
C -4.733113 2.732973 0.676745
C 5.663707 -0.514368 -0.808190
H -0.646836 -1.165264 1.138979
H 2.048338 -1.045392 0.509427
H -0.941233 1.694277 1.016248
H 1.714206 0.475619 -1.822946
H 2.778632 2.386535 -0.718693
H 2.271521 1.801779 0.923946
H -1.532535 -1.088915 -1.676705
H -6.297200 0.812415 -1.555994
H 1.468675 -0.802487 5.254189
H 2.413957 0.320377 4.218663
H 0.773727 0.780539 4.731211
H 0.160331 -4.077650 -1.901530
H 1.715493 -4.256965 -2.797668
H 0.500998 -3.032489 -3.301178
H -4.988256 3.568668 1.333729
H 5.243110 -1.534477 -0.880487
H 6.068468 -0.380293 0.207083
H 6.458541 -0.402251 -1.560217


