%chk=000072719.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072719

0 1
 O  -0.5267000       2.422000       1.209400    
 O   -1.864400      -1.636600       1.202500    
 O    2.385000     -0.7270000       1.225700    
 N   1.7400000E-02 -5.1000002E-03  7.0000000E-02
 N   -1.717200       3.054400     -0.6821000    
 N   -1.815400      -3.009800     -0.6703000    
 N    3.524400     -6.9600001E-02 -0.6887000    
 N   -1.751700       4.384800     -0.3163000    
 N   -2.970000      -3.676500     -0.3132000    
 N    4.692800     -0.6985000     -0.3085000    
 C   -1.161200      0.7328000     -0.3905000    
 C  -5.3800002E-02  -1.399500     -0.3729000    
 C    1.238900      0.6254000     -0.4095000    
 C   -1.080800       2.146400      0.1465000    
 C   -1.339400      -2.003400      0.1524000    
 C    2.422100     -0.1397000      0.1457000    
 H   -1.211100      0.7486000      -1.487200    
 H   -2.114900      0.3456000     -2.0600000E-02
 H  -2.7600000E-02  -1.467500      -1.468200    
 H   0.7485000      -2.029500      2.3200000E-02
 H    1.374500       1.654900     -6.3600004E-02
 H    1.277600      0.6353000      -1.506500    
 H   -2.174300       2.784000      -1.547300    
 H   -1.344800      -3.291500      -1.524500    
 H    3.517800      0.4369000      -1.568400    
 H   -1.331800       4.912400      -1.080600    
 H   -2.732900       4.659100     -0.2911000    
 H   -3.623100      -3.572600      -1.088800    
 H   -2.738200      -4.668000     -0.2717000    
 H    4.935300      -1.348000      -1.055400    
 H    5.423400      1.2100000E-02 -0.3055000    


%chk=000072719-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072719

0 1
O 0.538619 2.513508 -0.450357
O -2.538516 -0.807327 -0.546902
O 2.039087 -1.904498 -0.727304
N 0.001433 -0.014567 -2.362551
N -1.531222 1.611919 0.108252
N -0.602557 -1.857033 0.231085
N 2.078878 0.249508 0.166629
N -1.255891 1.711048 1.515264
N -0.784527 -1.517955 1.609974
N 2.199013 -0.167315 1.528286
C -0.698231 1.279024 -2.205728
C -0.757830 -1.272595 -2.180747
C 1.476473 -0.044293 -2.230774
C -0.536520 1.895520 -0.796129
C -1.399325 -1.358284 -0.771540
C 1.937571 -0.632983 -0.876319
H -0.277357 2.010152 -2.920402
H -1.763997 1.122286 -2.448478
H -1.590390 -1.315454 -2.906460
H -0.070139 -2.115028 -2.368893
H 1.851548 0.983256 -2.375643
H 1.906119 -0.697744 -3.012855
H -2.235410 0.882560 -0.128786
H 0.337837 -2.223466 -0.001404
H 1.873278 1.251829 0.023238
H -1.902486 2.376919 1.961971
H -0.274489 2.021627 1.625959
H -1.377818 -2.207522 2.090796
H -1.152267 -0.550324 1.713326
H 3.095201 -0.649056 1.677695
H 1.392314 -0.761810 1.802798


