%chk=000250249.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250249

0 1
O 1.838500 -3.422413 -0.262307
O -4.042086 -0.315848 0.443545
O -2.910240 0.764742 -1.199020
N -0.708337 -0.970626 -0.482236
C 0.588549 -1.349692 0.136306
C 1.359888 -2.244666 -0.904731
C 2.536941 -1.389915 -1.438900
C 1.526949 -0.186346 0.388159
C 2.617112 -0.209279 -0.516868
C 1.421748 0.815123 1.341090
C 3.593697 0.776483 -0.475436
C -1.712976 -0.520270 0.521776
C 2.410813 1.813976 1.383688
C 3.479045 1.795170 0.486498
C -2.900845 0.061861 -0.217793
C -5.328479 0.162066 -0.067681
C -5.535135 1.609513 0.324788
H 0.408682 -1.944356 1.065646
H 0.699449 -2.651618 -1.699532
H 2.357966 -1.072103 -2.483265
H 3.473780 -1.976822 -1.461604
H -0.567462 -0.232249 -1.189638
H 0.595915 0.835148 2.047997
H 4.430716 0.766973 -1.168806
H -2.032432 -1.407976 1.123362
H -1.340464 0.242776 1.244565
H 2.482667 -3.209992 0.443238
H 2.338400 2.607497 2.125300
H 4.237092 2.576481 0.529124
H -5.347249 0.009536 -1.161607
H -6.021568 -0.533635 0.440074
H -6.549450 1.949008 0.082821
H -5.378534 1.764266 1.399730
H -4.832753 2.269789 -0.206483


%chk=000250249-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250249

0 1
O 2.514571 -3.250487 -0.181480
O -3.995988 -0.150989 0.617527
O -2.873951 0.040543 -1.424347
N -0.698062 -1.354334 -0.349962
C 0.643586 -1.636576 0.220986
C 1.532030 -2.369977 -0.835423
C 2.240288 -1.224210 -1.620837
C 1.470214 -0.372546 0.509943
C 2.349352 -0.112684 -0.579554
C 1.419778 0.505430 1.613273
C 3.167560 1.033255 -0.579315
C -1.683200 -0.779562 0.571730
C 2.238949 1.662539 1.610740
C 3.102539 1.925963 0.520833
C -2.884916 -0.267619 -0.209573
C -5.229819 0.439448 0.003963
C -5.186779 1.968389 0.067269
H 0.505162 -2.279288 1.109335
H 0.934418 -3.046487 -1.463272
H 1.629381 -0.898610 -2.486750
H 3.213550 -1.561625 -2.018350
H -0.668722 -0.824426 -1.233507
H 0.777060 0.290988 2.475586
H 3.852253 1.234037 -1.411689
H -2.021962 -1.530821 1.308587
H -1.303082 0.096003 1.157834
H 3.105782 -2.690869 0.387163
H 2.212833 2.352226 2.462011
H 3.735692 2.820434 0.534369
H -5.307561 0.079985 -1.036932
H -6.044656 0.020010 0.614843
H -6.139982 2.382883 -0.310287
H -5.047112 2.316802 1.105126
H -4.369309 2.364777 -0.558041


