%chk=000001285.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001285

0 1
 O    3.456800      -1.471900     -0.1576000    
 O    5.519600     -0.4699000     -0.3658000    
 O   -4.511200     -0.4452000       1.074400    
 O   -2.384700      0.2057000       1.607700    
 C    2.059300      0.4194000     -0.2607000    
 C    2.153900      -1.017900      0.2536000    
 C   0.9584000       1.213200      0.4563000    
 C    3.487100      0.8153000     -8.0499999E-02
 C   0.5624000       2.491100     -0.2920000    
 C    1.103800      -1.910200     -0.3493000    
 C    4.313300     -0.4082000     -0.2133000    
 C  -0.7955000       2.989800      0.1479000    
 C   0.1321000      -2.584800      0.2963000    
 C  -0.8890000      -3.385000     -0.4895000    
 C    4.049500       1.990300      0.2097000    
 C   -1.947300       2.693200     -0.4859000    
 C   -2.327100      -2.861100     -0.3640000    
 C   -2.121700       1.803500      -1.688100    
 C  -0.7940000       3.878700       1.362100    
 C  -1.9800000E-02  -2.636200       1.792300    
 C   -3.267000      0.7913000      -1.539200    
 C   -2.556600      -1.565100      -1.096800    
 C   -2.961700     -0.3722000     -0.6247000    
 C   -3.220500     -0.1636000      0.8068000    
 H    1.856400      0.4080000      -1.341400    
 H    2.141000      -1.042600       1.348200    
 H    1.265700       1.460200       1.480500    
 H   7.3100001E-02  0.5731000      0.5470000    
 H   0.5696000       2.319100      -1.374000    
 H    1.305000       3.279300     -0.1279000    
 H    1.127200      -1.967500      -1.437200    
 H  -0.6136000      -3.437300      -1.551100    
 H  -0.8606000      -4.421200     -0.1278000    
 H    3.457100       2.887100      0.3393000    
 H    5.123000       2.092500      0.3313000    
 H   -2.868500       3.132100     -0.1052000    
 H   -2.617000      -2.781000      0.6891000    
 H   -3.001700      -3.606600     -0.8042000    
 H   -2.353900       2.454500      -2.540300    
 H   -1.203700       1.266000      -1.945000    
 H  -0.3745000       3.347300       2.222400    
 H   -1.801200       4.209000       1.637100    
 H  -0.1906000       4.773400       1.177200    
 H   -3.506400      0.4064000      -2.539900    
 H   -4.180600       1.297500      -1.200600    
 H  -0.2268000      -3.662800       2.114400    
 H  -0.8492000      -2.002600       2.117500    
 H   0.8754000      -2.323400       2.333100    
 H   -2.409100      -1.645500      -2.174300    
 H   -4.727300     -0.3191000       2.022900    


%chk=000001285-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001285

0 1
O 3.609352 -1.497150 -0.053785
O 5.676275 -0.431888 -0.239152
O -4.305383 0.773249 1.040923
O -2.797640 -0.807316 1.789543
C 2.125630 0.422739 -0.200867
C 2.196748 -1.059105 0.292424
C 1.002752 1.218784 0.498082
C 3.567148 0.875940 -0.049082
C 0.484710 2.434695 -0.327676
C 1.195259 -1.959948 -0.357292
C 4.439864 -0.350610 -0.124179
C -0.871857 2.934173 0.157760
C 0.202570 -2.651184 0.275367
C -0.823853 -3.425860 -0.542465
C 4.093913 2.112176 0.127800
C -2.051746 2.634837 -0.460553
C -2.293315 -2.904735 -0.376038
C -2.263198 1.813329 -1.718659
C -0.843941 3.783885 1.418247
C 0.008930 -2.710507 1.780102
C -3.381340 0.726906 -1.599916
C -2.563508 -1.607857 -1.103442
C -3.056768 -0.414635 -0.638732
C -3.325145 -0.210787 0.813116
H 1.899095 0.382376 -1.289457
H 2.130345 -1.087614 1.395068
H 1.341727 1.543767 1.500684
H 0.147626 0.531646 0.653158
H 0.429917 2.132969 -1.389890
H 1.220470 3.262325 -0.278286
H 1.259114 -1.999497 -1.454852
H -0.548559 -3.412083 -1.614769
H -0.817314 -4.486859 -0.218758
H 3.473653 3.012304 0.187191
H 5.179935 2.232000 0.218120
H -2.977212 3.038428 -0.021418
H -2.548625 -2.826878 0.691371
H -2.958091 -3.672509 -0.826096
H -2.567891 2.493109 -2.543320
H -1.327236 1.322757 -2.042273
H -0.390299 3.232230 2.265548
H -1.857079 4.098980 1.722905
H -0.231431 4.695632 1.270578
H -3.553460 0.303431 -2.607446
H -4.320345 1.215064 -1.284038
H -0.221013 -3.747908 2.090386
H -0.845771 -2.080685 2.091263
H 0.898792 -2.384596 2.342444
H -2.400815 -1.662598 -2.193367
H -4.432092 0.861176 2.024528


