%chk=000157704.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157704

0 1
 O    1.992600       2.045800      0.3916000    
 O   -3.784700     -0.4659000       1.271700    
 O   0.4863000       3.383200       1.532400    
 O   -2.628800      -2.255100      0.3652000    
 O    3.259400      -3.491100      -1.284800    
 O    2.036600      -2.182400      -2.554100    
 N   -1.680700       1.528800      -1.916700    
 N    2.384900      -2.601900      -1.423900    
 C  -0.8471000      0.5338000      0.6018000    
 C  -0.2418000       1.780200     -5.4200001E-02
 C   -2.053500     -1.7600000E-02 -0.1647000    
 C   0.2019000     -0.5319000      0.7409000    
 C  -0.6637000       2.209100      -1.265700    
 C   -2.396300      0.4720000      -1.377600    
 C   0.7970000      -1.063600     -0.3968000    
 C   0.7664000       2.512800      0.7291000    
 C   0.5658000     -0.9761000       2.006600    
 C  -0.1124000       3.393600      -2.012500    
 C   -3.527000     -3.1300001E-02  -2.233700    
 C   -2.839300      -1.064800      0.5082000    
 C    1.770500      -2.053900     -0.2671000    
 C    1.539300      -1.966500       2.136400    
 C    2.141700      -2.505400      0.9995000    
 C    3.087000       2.664800       1.075300    
 C   -4.636100      -1.360200       1.995800    
 C    4.382000       2.043600      0.5972000    
 H   -1.211300      0.8427000       1.592400    
 H   -1.966200       1.872300      -2.826900    
 H   0.5012000     -0.7045000      -1.379000    
 H   0.1050000     -0.5653000       2.900400    
 H  -0.9029000       4.131300      -2.186800    
 H   0.2843000       3.076800      -2.983000    
 H   0.6965000       3.897700      -1.476300    
 H   -4.256500      0.7677000      -2.404100    
 H   -4.059600     -0.8744000      -1.784700    
 H   -3.145800     -0.3640000      -3.205100    
 H    1.828100      -2.317500       3.122700    
 H    2.896500      -3.275000       1.138900    
 H    3.090500       3.739500      0.8614000    
 H    2.978100       2.508900       2.154400    
 H   -5.349000     -0.7615000       2.569100    
 H   -4.046200      -1.965100       2.691100    
 H   -5.191500      -1.999000       1.302300    
 H    5.241700       2.493000       1.101800    
 H    4.384000      0.9649000      0.7866000    
 H    4.496700       2.176100     -0.4837000    


%chk=000157704-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157704

0 1
O 1.922923 3.031831 0.389085
O -2.964209 -0.717403 1.750171
O 1.074726 1.785340 2.164620
O -4.320505 -0.716998 -0.146953
O 1.806334 -5.009049 -1.312433
O 0.583527 -3.555614 -2.571570
N -0.946972 1.140001 -2.141226
N 1.125778 -3.919969 -1.455152
C -0.743669 0.325064 0.567884
C 0.154056 1.422154 -0.036493
C -2.025009 0.147966 -0.249599
C 0.045556 -0.995823 0.694656
C 0.087948 1.715558 -1.388050
C -2.056836 0.482454 -1.592226
C 0.206614 -1.853721 -0.416090
C 1.060048 2.059948 0.929560
C 0.649067 -1.356607 1.927898
C 0.987183 2.638926 -2.182444
C -3.198475 0.241746 -2.553931
C -3.207038 -0.450823 0.388325
C 0.960215 -3.037506 -0.274768
C 1.395410 -2.551331 2.051445
C 1.562152 -3.410628 0.946875
C 2.843958 3.679035 1.371445
C -4.097809 -1.317156 2.485261
C 3.688350 4.682725 0.591923
H -1.009022 0.634728 1.591731
H -0.965875 1.335937 -3.142899
H -0.246297 -1.628295 -1.384933
H 0.537718 -0.682268 2.782686
H 0.814076 3.693346 -1.905989
H 0.806306 2.525833 -3.267526
H 2.047660 2.435966 -1.973046
H -4.087877 0.826481 -2.263076
H -3.518512 -0.812160 -2.533804
H -2.912631 0.515447 -3.586531
H 1.848875 -2.812482 3.013254
H 2.132871 -4.340585 1.009084
H 2.233967 4.159534 2.157519
H 3.455237 2.891661 1.848484
H -3.739138 -1.418471 3.519420
H -4.355270 -2.300492 2.056487
H -4.982876 -0.660593 2.432302
H 4.390565 5.190986 1.277667
H 4.277339 4.179668 -0.194435
H 3.053163 5.450241 0.116793


