%chk=000227640.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227640

0 1
O 4.095451 -0.630230 -0.074562
C -2.614352 -0.588543 0.074717
C -1.091111 -0.425476 0.056655
C -3.325472 0.734852 0.453199
C -0.481692 0.854334 0.039350
C -2.743668 1.928306 -0.304385
C -1.274350 2.130587 0.078570
C 0.910055 0.914102 0.007110
C 1.703427 -0.257489 -0.018030
C -3.021348 -1.654112 1.112387
C -3.054549 -1.037483 -1.332638
C 1.774800 2.151115 -0.004007
C -0.297319 -1.577930 0.022087
C 1.109654 -1.519821 -0.013818
C 3.226642 1.634716 -0.036956
C 3.138129 0.106944 -0.047375
C 1.913783 -2.772235 -0.045924
H -3.232274 0.907534 1.543233
H -4.408987 0.645821 0.253584
H -3.323654 2.843406 -0.082570
H -2.832213 1.767421 -1.396927
H -1.208385 2.558215 1.102228
H -0.820001 2.885375 -0.595389
H -2.611340 -1.424534 2.102142
H -4.109833 -1.720664 1.208724
H -2.661923 -2.651452 0.835754
H -2.581048 -1.981600 -1.622488
H -4.137826 -1.183303 -1.384568
H -2.781996 -0.292776 -2.089437
H 1.552200 2.785081 -0.882235
H 1.587371 2.775166 0.889104
H -0.775145 -2.557377 0.023688
H 3.811728 1.975573 0.834869
H 3.776907 1.989759 -0.925613
H 1.723919 -3.398727 0.836086
H 1.687775 -3.375834 -0.935428
H 3.001945 -2.568720 -0.065736


%chk=000227640-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227640

0 1
O 4.181491 -0.634443 -0.082999
C -2.629466 -0.594829 0.077497
C -1.092753 -0.419677 0.048526
C -3.341228 0.749465 0.418305
C -0.476439 0.869313 0.047376
C -2.750875 1.953329 -0.338954
C -1.283968 2.161313 0.085362
C 0.936153 0.924405 0.017179
C 1.735286 -0.248131 -0.024590
C -3.050941 -1.636370 1.154689
C -3.105022 -1.101250 -1.319531
C 1.795339 2.185684 0.022631
C -0.271893 -1.581197 -0.007035
C 1.138971 -1.541619 -0.043418
C 3.258582 1.669747 -0.002860
C 3.173793 0.128515 -0.043709
C 1.951852 -2.823521 -0.096093
H -3.253925 0.939132 1.508287
H -4.420985 0.638722 0.198656
H -3.338227 2.866799 -0.127618
H -2.806704 1.782064 -1.431617
H -1.260739 2.576539 1.115990
H -0.800507 2.922893 -0.557065
H -2.645182 -1.367995 2.147051
H -4.154466 -1.666486 1.230022
H -2.708038 -2.656945 0.909542
H -2.595545 -2.042008 -1.594747
H -4.194912 -1.291388 -1.305096
H -2.891940 -0.362747 -2.112903
H 1.569908 2.824413 -0.853220
H 1.589350 2.804853 0.916443
H -0.753210 -2.566805 -0.016915
H 3.837074 1.972492 0.888606
H 3.826612 2.022310 -0.882485
H 1.728561 -3.464347 0.777851
H 1.698066 -3.410828 -0.999026
H 3.031227 -2.611400 -0.108732


