%chk=000264671.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264671

0 1
O 1.552869 2.020356 -1.105191
N -4.589583 1.116991 0.078894
N -1.684033 -2.620812 0.483821
N -3.130731 -0.767381 0.106603
N -0.770342 -0.423247 0.679577
N -2.268285 1.500776 0.463998
N -0.028575 1.821423 1.173464
N 1.304069 1.376682 1.088775
C -3.305651 0.607193 0.193784
C -1.862242 -1.243155 0.393174
C -1.051976 0.923582 0.724413
C -4.770325 2.575612 -0.119466
C -5.657813 0.259436 -0.488437
C -0.301043 -3.157779 0.479575
C -2.708301 -3.511137 -0.115689
C 3.239375 0.569218 -0.172927
C 1.968602 1.355962 -0.179236
C 4.455283 1.221622 -0.411502
C 3.199882 -0.816433 0.033789
C 5.641280 0.481352 -0.429768
C 4.388764 -1.549751 0.008436
C 5.607928 -0.901039 -0.219604
H -5.799293 2.859872 0.150825
H -4.565943 2.888033 -1.156717
H -4.078950 3.138557 0.541118
H -6.643036 0.663724 -0.206665
H -5.581674 -0.766186 -0.075125
H -5.597594 0.183697 -1.586560
H 0.314045 -2.605188 1.216664
H 0.185913 -3.069237 -0.505452
H -0.314856 -4.217128 0.781113
H -2.604411 -4.524411 0.303318
H -2.635758 -3.562057 -1.214163
H -3.723097 -3.143596 0.137956
H -0.131943 2.786996 0.800603
H 1.484604 0.605718 1.752440
H 4.471918 2.298560 -0.586714
H 2.244718 -1.318061 0.200819
H 6.590804 0.983143 -0.612016
H 4.366797 -2.626912 0.165260
H 6.533801 -1.475494 -0.236187


%chk=000264671-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000264671

0 1
O 2.309112 2.789165 -0.090237
N -4.664578 1.150867 -0.093479
N -2.086576 -2.781161 0.269516
N -3.402933 -0.835731 0.086722
N -0.972493 -0.702971 0.087831
N -2.315363 1.340406 -0.096101
N 0.014981 1.395778 -0.093172
N 1.249439 0.748336 -0.031881
C -3.432098 0.535152 -0.033060
C -2.158485 -1.408095 0.144685
C -1.139845 0.654992 -0.031525
C -4.787709 2.608869 -0.221470
C -5.913324 0.382108 -0.037623
C -0.803961 -3.488697 0.347501
C -3.297630 -3.608747 0.333756
C 3.699076 0.773273 0.011025
C 2.397241 1.512586 -0.043111
C 4.863875 1.536771 0.279947
C 3.821314 -0.624983 -0.209502
C 6.127055 0.913444 0.344926
C 5.086471 -1.246858 -0.145095
C 6.242496 -0.481145 0.136320
H -5.348212 3.025472 0.638437
H -5.329920 2.870730 -1.151360
H -3.780959 3.048000 -0.249764
H -6.525824 0.701430 0.828575
H -5.667405 -0.684009 0.061448
H -6.506311 0.539720 -0.960121
H 0.012556 -2.756036 0.297210
H -0.704335 -4.206098 -0.491001
H -0.729901 -4.052545 1.298312
H -3.334428 -4.168162 1.289347
H -3.311603 -4.338976 -0.499246
H -4.175438 -2.952385 0.260287
H 0.051668 2.415800 -0.156964
H 1.148592 -0.267012 0.073423
H 4.747518 2.615337 0.427654
H 2.946448 -1.236160 -0.462565
H 7.019996 1.511928 0.555845
H 5.173071 -2.324449 -0.322797
H 7.223623 -0.966446 0.184308


