%chk=000075417.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075417

0 1
 O   0.5742000       1.302400      0.1279000    
 O   -4.605400      -2.378200      0.5346000    
 O   -6.168600       2.616300     -0.5455000    
 O    5.557600       2.500900      0.8000000    
 O    5.344600      -2.610300     -0.7441000    
 N   0.4183000     -0.8604000     -0.5292000    
 N   -2.102600      -1.774600      0.3010000    
 C   -3.942700     -0.1628000      4.4999998E-03
 C    4.200400      0.6872000      0.1720000    
 C    4.145100     -0.6544000     -0.2331000    
 C   -1.626000      0.5266000     -0.2430000    
 C   -4.362200       1.139300     -0.2759000    
 C   -2.576400     -0.4680000      2.0700000E-02
 C    1.838900      0.7921000      5.4699998E-02
 C    1.739500     -0.5297000     -0.3471000    
 C  -0.2154000      0.2536000     -0.2358000    
 C    3.031400       1.451600      0.3271000    
 C    2.912800      -1.283000     -0.4988000    
 C   -6.369300     -0.8889000      0.2635000    
 C   -4.930700      -1.224400      0.2847000    
 C   -6.788800      0.4131000     -1.7200001E-02
 C    6.743600      0.5422000      0.2882000    
 C    6.688000     -0.7927000     -0.1149000    
 C   -5.800700       1.474700     -0.2976000    
 C    5.504500       1.329200      0.4462000    
 C    5.389200      -1.438500     -0.3896000    
 C   -3.415400       2.136400     -0.5396000    
 C   -2.054800       1.828000     -0.5225000    
 C   -7.316000      -1.886000      0.5270000    
 C   -8.155200      0.7180000     -3.4000002E-02
 C    7.982100       1.142900      0.5453000    
 C    7.870800      -1.527700     -0.2611000    
 C   -8.676600      -1.577900      0.5087000    
 C   -9.095300     -0.2787000      0.2290000    
 C    9.158300      0.4072000      0.3981000    
 C    9.102800     -0.9254000     -4.3000001E-03
 H    3.038800       2.489300      0.6381000    
 H    2.852300      -2.319900     -0.8128000    
 H   -3.716700       3.156400     -0.7626000    
 H   -1.348100       2.625300     -0.7421000    
 H   -7.018200      -2.907400      0.7483000    
 H   -8.507200       1.723200     -0.2496000    
 H    8.052500       2.180600      0.8604000    
 H    7.854500      -2.568400     -0.5737000    
 H   -1.113500      -1.978500      0.3258000    
 H   -2.751500      -2.523500      0.4962000    
 H   -9.410600      -2.352100      0.7131000    
 H   -10.15520     -4.1499998E-02  0.2156000    
 H    10.11850      0.8741000      0.5976000    
 H    10.01970      -1.496400     -0.1181000    


%chk=000075417-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075417

0 1
O 0.647040 1.513277 -0.009058
O -4.649345 -2.538617 0.073103
O -6.286217 2.731199 -0.020131
O 5.754706 2.702143 -0.038751
O 5.318303 -2.800805 0.081944
N 0.416577 -0.795984 0.037888
N -2.133987 -1.773076 0.055896
C -4.016020 -0.200654 0.030032
C 4.315882 0.767803 0.004064
C 4.198274 -0.664640 0.034870
C -1.658593 0.624581 0.011039
C -4.452121 1.159322 0.005928
C -2.591635 -0.492227 0.032960
C 1.936339 0.945296 0.001677
C 1.790892 -0.476455 0.030966
C -0.235909 0.376409 0.014415
C 3.164794 1.597843 -0.012833
C 2.931458 -1.295906 0.048115
C -6.454482 -0.954740 0.049665
C -5.000506 -1.297708 0.051760
C -6.896528 0.398744 0.026192
C 6.866879 0.559697 0.007819
C 6.753580 -0.861338 0.039529
C -5.911352 1.515070 0.002750
C 5.655282 1.433625 -0.011064
C 5.418506 -1.533262 0.054066
C -3.521889 2.224338 -0.015864
C -2.145015 1.954899 -0.013330
C -7.409140 -2.001344 0.071690
C -8.283233 0.690147 0.025085
C 8.149353 1.161800 -0.005826
C 7.924788 -1.658329 0.057386
C -8.787047 -1.704792 0.070478
C -9.226154 -0.356048 0.047148
C 9.309195 0.361783 0.012026
C 9.196684 -1.051823 0.043860
H 3.280853 2.684060 -0.035615
H 2.873315 -2.386980 0.071255
H -3.905963 3.247420 -0.034295
H -1.421241 2.774801 -0.029699
H -7.044608 -3.032756 0.089513
H -8.591220 1.740286 0.006791
H 8.206890 2.254495 -0.030210
H 7.808795 -2.746360 0.081544
H -1.112451 -1.927134 0.057724
H -2.847821 -2.519110 0.070402
H -9.520738 -2.517755 0.087648
H -10.297539 -0.129376 0.046321
H 10.298450 0.831382 0.001423
H 10.099219 -1.671902 0.057806


