%chk=000225463.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225463

0 1
O -0.611434 2.337512 0.581296
O 5.503097 -0.079017 -1.019305
O 3.814013 0.014199 -2.367670
N -1.107563 0.130299 0.219783
N 4.316876 0.076928 -1.257585
C -2.549971 0.422470 -0.093882
C -0.664880 -1.299216 0.172342
C -3.250283 1.071032 1.117929
C -2.666222 1.324892 -1.339448
C -1.524307 -2.164865 1.119734
C -0.725774 -1.831624 -1.275726
C -4.727616 1.324622 0.793408
C -4.143527 1.578019 -1.664504
C -1.056110 -3.624655 1.067056
C -0.264110 -3.293693 -1.320128
C -4.879537 2.192052 -0.464711
C -1.087663 -4.170997 -0.367200
C -0.234892 1.177313 0.506412
C 1.217967 0.839973 0.734270
C 2.058014 0.595661 -0.354825
C 1.730905 0.863687 2.038780
C 3.418564 0.353076 -0.114151
C 3.091627 0.624149 2.261347
C 3.945183 0.367900 1.187295
H -3.046160 -0.561438 -0.313337
H 0.398581 -1.359296 0.526773
H -2.747515 2.031518 1.367241
H -3.152097 0.431481 2.011443
H -2.151287 0.867023 -2.201322
H -2.150976 2.292070 -1.148958
H -2.594198 -2.103920 0.838050
H -1.461134 -1.775904 2.152513
H -0.094885 -1.210415 -1.938267
H -1.753992 -1.749541 -1.677200
H -5.215725 1.822473 1.652683
H -5.258268 0.363674 0.655296
H -4.635012 0.633780 -1.966092
H -4.220113 2.254314 -2.537145
H -1.698369 -4.245280 1.720559
H -0.032164 -3.709993 1.479385
H 0.810217 -3.360209 -1.060433
H -0.347816 -3.679034 -2.354465
H -5.949991 2.325559 -0.705413
H -4.479078 3.205952 -0.265143
H -0.702990 -5.208097 -0.383633
H -2.134599 -4.228500 -0.722755
H 1.672263 0.593575 -1.381193
H 1.066538 1.078745 2.879865
H 3.488943 0.645311 3.277288
H 5.013670 0.182338 1.344645


%chk=000225463-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225463

0 1
O -0.655781 2.289700 0.977325
O 5.517972 -0.477735 -0.938546
O 3.629279 -0.833417 -2.165898
N -1.089564 0.128389 0.181235
N 4.240096 -0.408801 -1.108713
C -2.515962 0.479166 -0.139087
C -0.704159 -1.316499 0.098117
C -3.341972 0.876435 1.113760
C -2.614016 1.555416 -1.251055
C -1.547825 -2.204086 1.054027
C -0.753670 -1.864134 -1.352058
C -4.817783 1.143559 0.729489
C -4.094179 1.819329 -1.620354
C -1.065565 -3.675029 0.999619
C -0.277774 -3.336754 -1.402499
C -4.924991 2.219163 -0.377699
C -1.100907 -4.229302 -0.444057
C -0.248537 1.117716 0.668130
C 1.235558 0.837790 0.826621
C 2.025338 0.273522 -0.200642
C 1.872077 1.320300 2.000631
C 3.421439 0.184647 -0.020933
C 3.269725 1.206408 2.166387
C 4.065383 0.634836 1.151267
H -2.961115 -0.449648 -0.548165
H 0.340831 -1.387825 0.449208
H -2.896621 1.783523 1.558176
H -3.282496 0.070051 1.869882
H -2.049989 1.216272 -2.141769
H -2.144477 2.488559 -0.892824
H -2.617226 -2.164145 0.765202
H -1.472948 -1.809896 2.085539
H -0.129456 -1.235837 -2.015804
H -1.791020 -1.805413 -1.739313
H -5.382464 1.459023 1.627935
H -5.289104 0.203628 0.370700
H -4.535287 0.906427 -2.074275
H -4.146971 2.613835 -2.389262
H -1.692938 -4.296297 1.667033
H -0.028208 -3.736526 1.388883
H 0.794514 -3.385644 -1.121727
H -0.349530 -3.715067 -2.439714
H -5.984479 2.373691 -0.659968
H -4.549642 3.185348 0.016185
H -0.715664 -5.266496 -0.464021
H -2.153175 -4.270378 -0.794432
H 1.590958 -0.072447 -1.142080
H 1.256206 1.804873 2.764773
H 3.741802 1.574205 3.082784
H 5.150517 0.541471 1.242888


