%chk=000134996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134996

0 1
 O    8.019900       2.187500     -0.2961000    
 O   -2.069500      0.2067000      -1.653900    
 N   -3.117900      -1.141000     -7.7500001E-02
 N   -4.365300      -1.000700     -0.6631000    
 C    6.775000      0.2910000      0.5677000    
 C    7.204100      -1.171700      0.4375000    
 C    5.511300      0.6081000     -0.2062000    
 C    8.707100      -1.141100      0.6839000    
 C    9.190200      9.0999998E-02 -7.1099997E-02
 C    7.996000       1.006500      2.6900001E-02
 C    4.296700     -9.8700002E-02  0.3967000    
 C    2.980500      0.2466000     -0.3058000    
 C    1.768000     -0.4794000      0.2821000    
 C   0.4842000     -0.1051000     -0.4671000    
 C  -0.7509000     -0.7892000      0.1168000    
 C   -7.751200      0.2485000      0.6099000    
 C   -6.699100     -0.3395000     -0.3359000    
 C   -2.031400     -0.4975000     -0.6482000    
 C   -9.151400      0.3152000     -3.7000000E-03
 C   -5.307400     -0.4287000      0.2892000    
 C   -10.14430      0.9752000      0.9542000    
 C   -11.54480       1.016400      0.3637000    
 H    6.678600      0.5650000       1.625400    
 H    6.692500      -1.817600       1.157800    
 H    7.002900      -1.559000     -0.5692000    
 H    5.337900       1.691600     -0.1948000    
 H    5.622400      0.3287000      -1.261500    
 H    8.908200      -1.028300       1.756300    
 H    9.203500      -2.053900      0.3417000    
 H    10.07140      0.5352000      0.3964000    
 H    9.378600     -0.1350000      -1.124500    
 H    4.440400      -1.184800      0.3512000    
 H    4.211500      0.1657000       1.458100    
 H    2.817500       1.329800     -0.2473000    
 H    3.068900     -3.0000000E-03  -1.370600    
 H    1.924200      -1.563300      0.2257000    
 H    1.664600     -0.2206000       1.342600    
 H   0.3429000      0.9825000     -0.4383000    
 H   0.5879000     -0.3783000      -1.524800    
 H  -0.6025000      -1.876100      0.1207000    
 H  -0.8934000     -0.4690000       1.156000    
 H   -7.787800     -0.3534000       1.526500    
 H   -7.436700       1.257100      0.9061000    
 H   -7.025200      -1.340400     -0.6475000    
 H   -6.653900      0.2751000      -1.244300    
 H   -9.490100     -0.6980000     -0.2511000    
 H   -9.114700      0.8822000     -0.9417000    
 H   -5.357600      -1.044500       1.196000    
 H   -4.978600      0.5750000      0.5852000    
 H   -10.17070      0.4238000       1.901300    
 H   -9.819200       1.997000       1.182300    
 H   -3.032000      -1.734500      0.7421000    
 H   -4.672600      -1.934700     -0.9326000    
 H   -11.91260      6.6000000E-03  0.1555000    
 H   -12.23770       1.492700       1.064400    
 H   -11.55990       1.587200     -0.5702000    


%chk=000134996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134996

0 1
O 7.326444 2.721214 0.859034
O -2.196130 -1.305196 -1.705360
N -3.189937 -1.946803 0.325910
N -4.517351 -1.777221 -0.105916
C 6.641029 0.347690 0.560868
C 7.353163 -0.741027 -0.284381
C 5.194984 0.711536 0.160193
C 8.870958 -0.455707 -0.087804
C 8.961380 1.089841 -0.060904
C 7.608026 1.550708 0.504520
C 4.180267 -0.420740 0.433216
C 2.737151 -0.045868 0.027069
C 1.714060 -1.167408 0.315741
C 0.283399 -0.813436 -0.145203
C -0.737623 -1.930367 0.172478
C -7.519537 0.561539 0.537822
C -6.679202 -0.579911 -0.077258
C -2.094281 -1.682235 -0.507894
C -8.936739 0.660650 -0.070303
C -5.265590 -0.670952 0.528403
C -9.780288 1.807484 0.531960
C -11.194516 1.899934 -0.080907
H 6.633727 0.020172 1.626413
H 7.076536 -1.766936 0.012255
H 7.078071 -0.616489 -1.351061
H 4.898309 1.624597 0.712783
H 5.174568 0.975452 -0.917329
H 9.209080 -0.870893 0.880820
H 9.492508 -0.908731 -0.878809
H 9.798887 1.502943 0.527228
H 9.054753 1.503180 -1.086077
H 4.483295 -1.337644 -0.113160
H 4.202543 -0.678614 1.513451
H 2.433534 0.877488 0.562577
H 2.713000 0.200893 -1.054606
H 2.039488 -2.098746 -0.194353
H 1.714655 -1.391662 1.403553
H -0.041224 0.132168 0.334016
H 0.266772 -0.634550 -1.236675
H -0.348025 -2.891830 -0.219815
H -0.849830 -2.054113 1.268534
H -7.601861 0.415273 1.635392
H -6.990507 1.525818 0.389793
H -7.211847 -1.543994 0.072642
H -6.581484 -0.435191 -1.170011
H -9.470324 -0.301635 0.078807
H -8.855361 0.803924 -1.167802
H -5.343379 -0.784892 1.640070
H -4.712883 0.266101 0.332038
H -9.859860 1.664492 1.629213
H -9.247369 2.768561 0.381721
H -2.999636 -2.173954 1.313015
H -5.028922 -2.667209 -0.158235
H -11.759185 0.962319 0.081592
H -11.776789 2.726710 0.365847
H -11.142407 2.074169 -1.172210


