%chk=000247968.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247968

0 1
O 1.840771 4.085811 1.443228
N -0.873958 1.280860 -0.603435
N 2.519115 -1.396691 -0.984535
C 1.062107 2.839127 -0.402772
C 1.285785 0.382663 0.200503
C 2.016979 1.637301 -0.314324
C -0.201998 2.477287 -1.212212
C 0.034988 0.088069 -0.657186
C 0.674360 3.359822 0.991419
C -2.163852 0.996493 -1.320059
C 2.236373 -0.799102 0.207007
C -2.968481 -0.040478 -0.571683
C 2.815295 -1.240821 1.415763
C -3.523759 -1.127822 -1.261705
C -3.191188 0.094270 0.807451
C 3.699461 -2.320039 1.388388
C 3.381123 -2.446528 -0.993051
C 3.993077 -2.939763 0.169437
C -4.300187 -2.067581 -0.576897
C -3.964569 -0.849157 1.487029
C -4.522736 -1.930531 0.796352
H 1.597072 3.671292 -0.930502
H 0.941188 0.579113 1.249734
H 2.864551 1.889977 0.353375
H 2.456898 1.433802 -1.310415
H -0.918077 3.326429 -1.194552
H 0.081782 2.318866 -2.275571
H 0.335683 -0.186295 -1.692363
H -0.508785 -0.785926 -0.236901
H 0.448416 2.543934 1.698766
H -0.176466 4.061336 0.951952
H -2.010001 0.689308 -2.378499
H -2.756513 1.941590 -1.351599
H 2.576355 -0.745322 2.353223
H 1.729181 4.354422 2.371464
H -3.352300 -1.246399 -2.329315
H -2.744430 0.933165 1.341789
H 4.157920 -2.677386 2.310289
H 3.576414 -2.894597 -1.974133
H 4.677309 -3.781622 0.120855
H -4.730647 -2.909340 -1.116261
H -4.133612 -0.742545 2.556915
H -5.126743 -2.662894 1.326930


%chk=000247968-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247968

0 1
O 1.783095 3.892326 1.625116
N -0.823302 1.213991 -0.695461
N 2.848607 -1.139719 -0.988078
C 1.034159 2.864794 -0.440671
C 1.354216 0.397852 0.224220
C 2.039156 1.695942 -0.289703
C -0.182277 2.416296 -1.283549
C 0.120691 0.068509 -0.655631
C 0.575138 3.433405 0.913014
C -2.097795 0.866874 -1.366789
C 2.332084 -0.766822 0.229074
C -2.966116 -0.095399 -0.559608
C 2.698162 -1.433575 1.426459
C -3.729713 -1.094320 -1.211713
C -3.064717 0.028876 0.849469
C 3.616804 -2.505432 1.374152
C 3.731063 -2.177533 -1.025860
C 4.147336 -2.890708 0.122003
C -4.584934 -1.946574 -0.475234
C -3.914215 -0.823006 1.588968
C -4.681035 -1.812750 0.928813
H 1.542814 3.687636 -0.981795
H 0.999213 0.559169 1.260228
H 2.850872 1.998482 0.395148
H 2.494744 1.469800 -1.273123
H -0.935972 3.226913 -1.330704
H 0.164061 2.220889 -2.331866
H 0.482895 -0.200691 -1.678688
H -0.412020 -0.808073 -0.245207
H 0.037407 2.658445 1.495386
H -0.119112 4.284105 0.737144
H -1.930933 0.439075 -2.388710
H -2.656030 1.814483 -1.512471
H 2.267178 -1.110113 2.380005
H 1.522998 4.270072 2.501728
H -3.652519 -1.208190 -2.300594
H -2.456228 0.792064 1.347656
H 3.911763 -3.029498 2.289850
H 4.115421 -2.441220 -2.018712
H 4.861133 -3.715888 0.033499
H -5.168761 -2.715563 -0.994146
H -3.980537 -0.716857 2.678207
H -5.340891 -2.473971 1.502070


