%chk=000064991.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064991

0 1
 O   -4.819200      -1.538500      0.1300000    
 O    4.420400     -0.1009000      0.1812000    
 N   0.1728000       1.436700      1.2500000E-02
 N   0.4679000     -0.9730000     -0.1352000    
 N    2.340700       1.989300      0.1916000    
 N    2.755200      -1.698100     -3.7000000E-02
 N   0.9733000      -3.225200     -0.2575000    
 C   -1.279700       1.597700     -6.9700003E-02
 C   -2.046400      0.8457000       1.033000    
 C   -3.325500      0.3108000      0.3666000    
 C   -1.877000       1.057000      -1.332100    
 C   -2.986900      0.3527000      -1.091900    
 C   -3.685800      -1.086200      0.8506000    
 C   0.8890000      0.2891000     -2.0099999E-02
 C    1.100600       2.445900      0.1421000    
 C    2.204600      0.6334000      8.9199997E-02
 C    3.233300     -0.3875000      8.5100003E-02
 C    1.462600      -1.948900     -0.1384000    
 H   -1.486100       2.673700     -9.6000005E-03
 H   -2.298800       1.525500       1.856100    
 H   -1.460800      3.6300000E-02   1.483700    
 H   -4.169600      0.9908000      0.5384000    
 H   -1.480800       1.243500      -2.320400    
 H   -3.593700     -8.9699998E-02  -1.869500    
 H   -3.928700      -1.073600       1.918100    
 H   -2.867200      -1.795500      0.6850000    
 H   0.8146000       3.487600      0.1956000    
 H  -0.5072000      -1.237100     -0.2263000    
 H   -5.032200      -2.427900      0.4601000    
 H  -2.1800000E-02  -3.405300     -0.3335000    
 H    1.595000      -4.026300     -0.2719000    


%chk=000064991-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064991

0 1
O -4.765150 -1.639313 0.338081
O 4.443493 -0.298732 0.661366
N 0.153350 1.468522 -0.033138
N 0.465622 -0.993827 -0.392537
N 2.308510 1.981348 0.561306
N 2.727182 -1.768510 0.007068
N 1.066411 -3.268730 -0.679230
C -1.306366 1.630867 -0.221598
C -2.154103 1.094647 0.987788
C -3.363539 0.324038 0.368385
C -1.853973 0.853261 -1.417097
C -2.966385 0.144484 -1.090766
C -3.677091 -0.997478 1.090361
C 0.887344 0.288858 -0.064705
C 1.079086 2.468239 0.360121
C 2.209619 0.599256 0.297169
C 3.234399 -0.463552 0.350735
C 1.470868 -1.988221 -0.338929
H -1.464232 2.717410 -0.365293
H -2.471021 1.912228 1.655174
H -1.524682 0.408886 1.586295
H -4.286045 0.937875 0.408202
H -1.405154 0.937337 -2.412130
H -3.571395 -0.459142 -1.773391
H -3.979069 -0.788312 2.138445
H -2.772365 -1.645484 1.108035
H 0.779316 3.508636 0.468001
H -0.475228 -1.160708 -0.759022
H -5.126866 -2.403212 0.851768
H 0.112169 -3.513573 -0.928040
H 1.787895 -3.985096 -0.656625


