%chk=000090433.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090433

0 1
 O    1.453500       2.353700     -3.8400002E-02
 O    6.503000      -1.471100      1.5200000E-02
 N   -2.233500      0.2994000      2.5000000E-02
 C   -1.036900       1.133100      6.8000001E-03
 C   0.2299000      0.2782000      4.2599998E-02
 C   -3.436400       1.116100     -5.2099999E-02
 C    1.526900       1.108400      1.9999999E-04
 C   -4.686500      0.2774000     -2.6600000E-02
 C    2.818200      0.4392000      4.4000000E-03
 C   -5.227900     -0.1784000      -1.220500    
 C   -5.280100     -2.8000001E-02   1.190100    
 C    2.881600     -0.9535000      4.7200002E-02
 C    3.993000       1.189900     -3.4800000E-02
 C    4.120000      -1.595500      5.0600000E-02
 C    5.231500      0.5479000     -3.1300001E-02
 C    5.295000     -0.8447000      1.1500000E-02
 C   -6.386000     -0.9554000      -1.197100    
 C   -6.438300     -0.8049000       1.213400    
 C   -6.991300      -1.268700      1.9900000E-02
 C    7.664300     -0.6429000     -2.6100000E-02
 H   -1.038100       1.808400      0.8714000    
 H   -1.023200       1.756800     -0.8959000    
 H   0.2341000     -0.3164000      0.9640000    
 H   0.2293000     -0.3936000     -0.8242000    
 H   -3.432500       1.724300     -0.9664000    
 H   -3.469200       1.825900      0.7849000    
 H   -2.205900     -0.3456000     -0.7647000    
 H   -4.763600      5.8200002E-02  -2.173800    
 H   -4.857000      0.3266000       2.125700    
 H    1.995000      -1.578500      7.9800002E-02
 H    3.969300       2.276000     -6.8599999E-02
 H    4.163800      -2.680800      8.4200002E-02
 H    6.104000       1.191500     -6.3000001E-02
 H   -6.816400      -1.317000      -2.126500    
 H   -6.909400      -1.049300       2.161100    
 H   -7.892900      -1.873900      3.7999999E-02
 H    7.737200     -7.4000000E-03  0.8631000    
 H    7.713200     -6.4499997E-02 -0.9549000    
 H    8.535100      -1.306700     -1.6799999E-02


%chk=000090433-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090433

0 1
O 1.484716 2.453379 -0.376925
O 6.527424 -1.513018 0.418680
N -2.249013 0.397214 -0.303764
C -1.034597 1.231042 -0.439707
C 0.218315 0.380813 -0.178596
C -3.520661 1.142389 -0.436957
C 1.515675 1.194391 -0.213768
C -4.734807 0.257548 -0.174448
C 2.817799 0.476132 -0.045483
C -5.929739 0.438456 -0.914784
C -4.697874 -0.741104 0.832332
C 2.906297 -0.928845 0.177680
C 4.022128 1.226285 -0.109116
C 4.151127 -1.557776 0.328582
C 5.278659 0.612183 0.038083
C 5.343553 -0.790102 0.257959
C -7.071646 -0.351784 -0.648013
C -5.835496 -1.535569 1.096983
C -7.028053 -1.342494 0.359896
C 7.796476 -0.777869 0.357560
H -1.083122 2.045613 0.306284
H -0.944377 1.729362 -1.434303
H 0.117293 -0.110439 0.810456
H 0.287038 -0.442342 -0.920694
H -3.638574 1.638175 -1.432793
H -3.492315 1.962884 0.310330
H -2.230253 -0.417176 -0.934846
H -5.967057 1.201059 -1.703244
H -3.766685 -0.882353 1.391217
H 1.998208 -1.537217 0.238512
H 3.942500 2.305646 -0.277853
H 4.233263 -2.634843 0.501712
H 6.188039 1.217551 -0.017844
H -7.988895 -0.199112 -1.228352
H -5.794432 -2.303621 1.878224
H -7.910769 -1.958563 0.565988
H 7.857702 -0.018395 1.160209
H 7.930621 -0.292879 -0.628148
H 8.574332 -1.540421 0.506351


