%chk=000112067.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112067

0 1
 O    3.738700     -0.3703000      -1.494200    
 C   0.4476000      0.3783000     -5.5300001E-02
 C    1.759900      0.9423000      0.4858000    
 C   -2.491100     -2.7500000E-02  0.1257000    
 C  -0.1647000     -0.6173000      0.9381000    
 C  -0.5391000       1.509600     -0.3705000    
 C   -1.504200      -1.158700      0.4416000    
 C   -1.878500      0.9683000     -0.8673000    
 C    2.748600     -0.2452000      0.7125000    
 C   -3.802800     -0.5917000     -0.4166000    
 C    2.337000       1.935800     -0.5445000    
 C    1.470100       1.703900       1.794300    
 C    3.077400      -1.138100     -0.4941000    
 C   -4.433200      -1.548400      0.5927000    
 C   -4.770100      0.5377000     -0.7631000    
 C    4.004400      -2.278700     -8.5100003E-02
 H   0.6200000     -0.1461000      -1.003500    
 H   -2.695400      0.5135000       1.061100    
 H  -0.3519000     -0.1644000       1.915800    
 H   0.4840000      -1.483200       1.097800    
 H  -0.1510000       2.176300      -1.147400    
 H  -0.7589000       2.124900      0.5062000    
 H   -1.338100      -1.774900     -0.4513000    
 H   -1.895700      -1.820100       1.221400    
 H   -2.535200       1.830700      -1.021900    
 H   -1.737200      0.4891000      -1.844500    
 H    3.693500      0.1985000       1.060800    
 H    2.413000     -0.8655000       1.551700    
 H   -3.612000      -1.158400      -1.337700    
 H    1.830400       2.907100     -0.5045000    
 H    2.254300       1.570900      -1.573100    
 H    3.394300       2.138900     -0.3383000    
 H    1.097200       1.066600       2.599500    
 H   0.8051000       2.562600       1.680600    
 H    2.413500       2.119300       2.174000    
 H    2.173200      -1.570500     -0.9306000    
 H   -4.517100      -1.090600       1.584200    
 H   -5.442000      -1.835000      0.2745000    
 H   -3.866400      -2.479500      0.6846000    
 H   -4.883500       1.241700      6.8400003E-02
 H   -5.763800      0.1370000     -0.9938000    
 H   -4.452600       1.091600      -1.651700    
 H    3.543600      -2.910500      0.6803000    
 H    4.247600      -2.904400     -0.9508000    
 H    4.954700      -1.893300      0.3006000    
 H    3.914100     -0.9579000      -2.248800    


%chk=000112067-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000112067

0 1
O 3.653695 -0.559339 -1.608512
C 0.453434 0.502507 -0.012184
C 1.863916 1.041614 0.445565
C -2.554786 -0.045680 0.116193
C -0.159095 -0.573493 0.925266
C -0.606805 1.615443 -0.224569
C -1.487445 -1.143027 0.370944
C -1.936311 1.056628 -0.785369
C 2.875986 -0.136934 0.667359
C -3.876251 -0.630487 -0.477348
C 2.432405 2.017594 -0.623916
C 1.771553 1.807264 1.797126
C 3.027469 -1.208563 -0.429056
C -4.492133 -1.726044 0.430833
C -4.937320 0.468142 -0.740466
C 3.896348 -2.388566 0.050558
H 0.610659 0.024831 -1.005592
H -2.806677 0.418820 1.098050
H -0.350899 -0.126525 1.922807
H 0.549522 -1.408745 1.085217
H -0.223669 2.389461 -0.914945
H -0.812034 2.119191 0.742498
H -1.288378 -1.672422 -0.586354
H -1.875151 -1.899332 1.079038
H -2.648798 1.893182 -0.913725
H -1.757810 0.630234 -1.796547
H 3.880724 0.300430 0.839247
H 2.602596 -0.668455 1.601018
H -3.621723 -1.099883 -1.453969
H 1.826938 2.939790 -0.692001
H 2.480204 1.537085 -1.614857
H 3.463914 2.314673 -0.356967
H 1.356559 1.177279 2.606031
H 1.140113 2.709236 1.706285
H 2.778443 2.139594 2.114663
H 2.028566 -1.596905 -0.723779
H -4.687844 -1.327366 1.445854
H -5.455891 -2.077528 0.017251
H -3.834605 -2.607006 0.533379
H -5.156525 1.030163 0.188587
H -5.884382 0.016535 -1.090727
H -4.611773 1.191894 -1.507433
H 3.434879 -2.893934 0.919202
H 4.022465 -3.146962 -0.747123
H 4.899059 -2.030715 0.347475
H 3.854562 -1.259278 -2.281408


