%chk=000089606.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089606

0 1
 O   0.8308000     -0.4158000      5.2999999E-02
 O   -2.139500       1.243100     -0.3162000    
 O    2.228900     -0.3974000      -1.769000    
 O   -2.694900       2.785600       1.300100    
 N    2.959900      0.2687000      0.3295000    
 N   -2.667000       3.349700     -0.9289000    
 C   -1.526700      -1.105600      6.3500002E-02
 C   -2.613700      -1.624000     -0.9250000    
 C   -1.281400      -2.087900       1.247600    
 C  -0.2272000     -0.9020000     -0.7632000    
 C   -1.950200      0.2531000      0.6869000    
 C   -3.997400      -1.854300     -0.3295000    
 C  -0.8104000      -3.485600      0.8643000    
 C    2.030000     -0.1989000     -0.5751000    
 C    4.323900      0.5943000     -1.8300001E-02
 C   -2.515600       2.482900      0.1251000    
 C    5.209900     -0.6388000      0.1028000    
 C    4.840500       1.732800      0.8525000    
 H   -2.277900      -2.560000      -1.387900    
 H   -2.722200     -0.9110000      -1.752900    
 H  -0.5332000      -1.659900       1.927800    
 H   -2.196300      -2.184300       1.844700    
 H   8.1400000E-02  -1.845800      -1.228700    
 H  -0.4051000     -0.1830000      -1.573300    
 H   -1.173300      0.6038000       1.378800    
 H   -2.874300      0.1404000       1.266100    
 H   -4.433500     -0.9288000      5.6100000E-02
 H   -3.975100      -2.594900      0.4743000    
 H   -4.672800      -2.233000      -1.104200    
 H  -0.6835000      -4.091800       1.767700    
 H   0.1544000      -3.462800      0.3506000    
 H   -1.536500      -3.997400      0.2271000    
 H    4.336700      0.9245000      -1.064100    
 H    2.676500      0.3444000       1.302000    
 H    6.242400     -0.4083000     -0.1794000    
 H    4.853600      -1.443200     -0.5500000    
 H    5.214100      -1.025400       1.128100    
 H    5.862000       2.008900      0.5711000    
 H    4.207500       2.620600      0.7455000    
 H    4.841400       1.454900       1.912400    
 H   -2.506800       3.051300      -1.885200    
 H   -2.943500       4.314900     -0.7839000    


%chk=000089606-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089606

0 1
O 0.825648 -0.405836 0.108652
O -2.234702 1.223025 -0.390711
O 2.277611 -0.363427 -1.754398
O -2.595670 2.894715 1.233940
N 2.961224 0.330283 0.385065
N -2.746198 3.331535 -1.069414
C -1.534966 -1.089854 0.065423
C -2.635201 -1.616857 -0.911694
C -1.267881 -2.072779 1.251559
C -0.259928 -0.885648 -0.783845
C -1.949520 0.255579 0.701711
C -4.005593 -1.930304 -0.273700
C -0.855140 -3.505535 0.850432
C 2.061047 -0.160766 -0.530100
C 4.364172 0.630699 0.021567
C -2.533027 2.530353 0.033357
C 5.228798 -0.652515 0.009007
C 4.917727 1.696559 0.987840
H -2.253369 -2.529672 -1.410614
H -2.777037 -0.860809 -1.707560
H -0.472620 -1.637036 1.886000
H -2.179336 -2.123002 1.880046
H 0.063104 -1.827634 -1.262708
H -0.429240 -0.132266 -1.573150
H -1.137053 0.661117 1.329265
H -2.856103 0.149417 1.324244
H -4.456499 -1.035611 0.192024
H -3.934118 -2.718092 0.498081
H -4.710492 -2.286871 -1.046928
H -0.680539 -4.117031 1.754575
H 0.080810 -3.513528 0.263038
H -1.636287 -4.011334 0.254249
H 4.340059 1.039853 -1.005732
H 2.655102 0.428366 1.354183
H 6.257737 -0.421556 -0.323210
H 4.800302 -1.394647 -0.686411
H 5.282078 -1.100715 1.018738
H 5.952930 1.960427 0.710202
H 4.305863 2.615734 0.962385
H 4.938721 1.316879 2.028217
H -2.660403 2.953044 -2.009253
H -2.976112 4.309742 -0.921571


