%chk=000227828.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227828

0 1
O -3.600966 0.887394 -1.849633
O 2.384578 3.206725 -1.756891
O 1.486219 -3.407297 -1.627815
O -5.256487 -1.125725 -0.571364
O 1.864350 5.226999 -0.247240
O 3.777689 -3.938022 0.071973
C -0.031528 0.109413 1.361989
C -1.417574 -0.201506 0.825403
C 0.469323 1.477152 0.932049
C 0.969589 -0.976074 1.006540
C -1.945488 0.461460 -0.287313
C 1.203475 1.633938 -0.262516
C 0.823378 -1.752272 -0.149352
C -2.177894 -1.187602 1.475591
C 0.191681 2.584163 1.733544
C 2.066690 -1.187308 1.855841
C -3.233015 0.148536 -0.752024
C 1.657805 2.893974 -0.633711
C 1.767354 -2.743374 -0.458671
C -3.458967 -1.509149 1.023560
C 0.643561 3.864121 1.368579
C 3.012599 -2.171613 1.560401
C -3.990273 -0.844991 -0.086131
C 1.372897 4.022104 0.196262
C 2.867636 -2.950093 0.408645
C -4.913968 0.646763 -2.418708
C 2.695690 2.119202 -2.664144
C 2.373884 -4.484117 -2.025648
H -0.119601 0.124485 2.487854
H -1.379071 1.233439 -0.813215
H 1.408613 0.762308 -0.882039
H -0.023371 -1.608523 -0.824553
H -1.766778 -1.716527 2.333557
H -0.385917 2.473965 2.649194
H 2.193223 -0.576888 2.748251
H -4.039944 -2.274907 1.531760
H 0.418590 4.718003 2.001528
H 3.859910 -2.328947 2.223535
H -5.684979 -1.840967 -0.040135
H 1.612252 5.961658 0.365812
H 4.498775 -3.995409 0.746122
H -5.690107 0.869404 -1.679222
H -4.989244 -0.389576 -2.763739
H -4.929744 1.356829 -3.252753
H 3.316850 1.370338 -2.164724
H 3.260890 2.643782 -3.445670
H 1.777045 1.684688 -3.068784
H 2.383935 -5.265991 -1.259423
H 3.382415 -4.094126 -2.197996
H 1.905224 -4.829139 -2.953775


%chk=000227828-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227828

0 1
O -3.603426 0.538820 -2.121294
O 2.448906 3.333946 -1.711188
O 1.861632 -3.374069 -1.790334
O -5.222968 -1.433964 -0.762043
O 1.624866 5.410270 -0.227457
O 4.127162 -3.782834 -0.042979
C -0.006174 0.063500 1.292667
C -1.402989 -0.293835 0.752990
C 0.446700 1.481270 0.901384
C 1.051632 -1.001528 0.951980
C -1.941186 0.296705 -0.412799
C 1.260667 1.714280 -0.236180
C 0.986031 -1.785791 -0.222866
C -2.180660 -1.262285 1.435614
C 0.019850 2.587323 1.668338
C 2.155118 -1.184638 1.821393
C -3.214481 -0.061523 -0.912005
C 1.647307 3.021474 -0.608044
C 1.993027 -2.722140 -0.552413
C -3.451542 -1.633347 0.952517
C 0.400296 3.900006 1.307941
C 3.166670 -2.116185 1.511777
C -3.972681 -1.052098 -0.226012
C 1.209772 4.130250 0.176748
C 3.105689 -2.877868 0.322674
C -4.968742 1.096396 -2.211951
C 2.899447 2.215811 -2.544920
C 2.057922 -4.838364 -1.828080
H -0.095492 0.065082 2.399131
H -1.387718 1.066293 -0.959530
H 1.605737 0.856583 -0.820753
H 0.139936 -1.694697 -0.911412
H -1.788007 -1.734582 2.343427
H -0.615530 2.429751 2.547345
H 2.230221 -0.588929 2.738268
H -4.042499 -2.390186 1.486720
H 0.066863 4.753533 1.913567
H 4.021211 -2.244527 2.190461
H -5.612957 -2.167983 -0.225609
H 1.255913 6.093329 0.386765
H 4.859414 -3.755739 0.621669
H -5.118470 1.874124 -1.437859
H -5.729641 0.306904 -2.103918
H -5.018969 1.552493 -3.212420
H 3.529252 1.509914 -1.969301
H 3.495371 2.680615 -3.343793
H 2.042529 1.669998 -2.985396
H 1.328991 -5.340483 -1.162530
H 3.084748 -5.110388 -1.535513
H 1.862454 -5.119988 -2.873978


