%chk=000072137.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072137

0 1
 O   0.9147000     -0.7002000       1.504300    
 O   -1.944100       2.737700      0.1864000    
 O  -0.4544000       1.765600      -1.274600    
 N    3.303100     -0.2192000      0.2093000    
 N  -0.1392000     -0.8744000     -0.5864000    
 C    2.247600     -0.9500000     -0.4912000    
 C    4.579600     -0.3719000     -0.4877000    
 C    2.952200       1.195400      0.3291000    
 C   0.9475000     -0.8270000      0.2844000    
 C   -1.513400     -0.7930000     -0.2575000    
 C    4.995700      -1.826000     -0.5713000    
 C    4.030900       1.975400       1.052200    
 C   -2.215700      -1.956900      1.8999999E-02
 C   -2.135400      0.4462000     -0.2170000    
 C   -3.570100      -1.879700      0.3433000    
 C   -3.489900      0.5234000      0.1074000    
 C   -1.561700      -3.300200     -1.9900000E-02
 C   -4.207200     -0.6394000      0.3874000    
 C   -1.417300       1.682100     -0.5039000    
 C   -1.323000       4.012200     -1.3200000E-02
 H    2.445100      -2.026700     -0.5289000    
 H    2.124800     -0.5840000      -1.518400    
 H    5.385000      0.1247000      6.2600002E-02
 H    4.551100      6.4199999E-02  -1.494300    
 H    2.779700       1.649800     -0.6555000    
 H    2.034000       1.340400      0.9063000    
 H   3.8600001E-02  -1.179700      -1.540900    
 H    4.918000      -2.327600      0.3996000    
 H    4.412600      -2.387300      -1.307800    
 H    6.042800      -1.891800     -0.8885000    
 H    3.643200       2.961700       1.332600    
 H    4.910200       2.158500      0.4268000    
 H    4.344900       1.477300       1.975900    
 H   -4.144600      -2.775400      0.5642000    
 H   -4.021200       1.471100      0.1362000    
 H  -0.7964000      -3.375100      0.7595000    
 H   -2.281300      -4.109000      0.1477000    
 H   -1.101400      -3.476800     -0.9977000    
 H   -5.262600     -0.5800000      0.6367000    
 H   -1.845700       4.746400      0.6053000    
 H  -0.2742000       3.973000      0.2960000    
 H   -1.405700       4.311200      -1.062200    


%chk=000072137-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072137

0 1
O 1.056420 -1.145914 1.336782
O -2.918814 2.897409 -0.914263
O -0.895045 2.025058 -1.629325
N 3.541580 -0.337168 0.118355
N -0.137813 -0.285254 -0.506535
C 2.295596 -0.304564 -0.649823
C 4.746440 -0.427113 -0.745062
C 3.629182 0.733227 1.148741
C 1.036551 -0.633884 0.185896
C -1.477684 -0.443704 -0.065154
C 4.922962 -1.806691 -1.409410
C 4.553937 0.352618 2.320175
C -1.942872 -1.666574 0.514871
C -2.401450 0.645041 -0.267588
C -3.282773 -1.722578 0.969497
C -3.739831 0.536248 0.193712
C -1.086723 -2.912952 0.578723
C -4.174777 -0.634898 0.834370
C -1.979602 1.872788 -0.984433
C -2.571515 4.138373 -1.646036
H 2.351031 -1.065315 -1.451582
H 2.121076 0.677906 -1.170341
H 5.624241 -0.237662 -0.102223
H 4.751546 0.374345 -1.529834
H 3.957236 1.704796 0.697289
H 2.614946 0.889062 1.554668
H -0.032669 0.443428 -1.236056
H 4.928923 -2.597060 -0.639217
H 4.116077 -2.036192 -2.129458
H 5.878358 -1.843721 -1.965278
H 4.557108 1.154456 3.082142
H 5.599648 0.195504 1.997860
H 4.190332 -0.579154 2.784861
H -3.637126 -2.658482 1.417587
H -4.417280 1.378806 0.035517
H -0.355213 -2.853682 1.403671
H -1.718264 -3.807556 0.714778
H -0.498886 -3.039371 -0.349409
H -5.204369 -0.717572 1.196537
H -3.425452 4.808384 -1.475249
H -1.639501 4.569666 -1.244632
H -2.438731 3.924944 -2.719826


