%chk=000157187.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157187

0 1
 O  -0.2106000      0.1220000      -1.456000    
 O   -3.486900       3.635000     -0.3007000    
 N   -2.593600      5.4600000E-02 -0.2086000    
 N   0.8828000     -0.3949000      0.5624000    
 C   -1.472800     -0.7036000      0.3775000    
 C   -1.618000      -2.214100      0.1466000    
 C   -2.956000      -2.734000      0.6530000    
 C   -3.886000     -0.4240000      0.3141000    
 C   -4.091900      -1.915700      5.6100000E-02
 C   -2.478500       1.495100      5.2400000E-02
 C  -0.2037000     -0.2723000     -0.2944000    
 C   -3.628900       2.251100     -0.5928000    
 C    2.236000     -8.6400002E-02  0.2866000    
 C    3.066000      -1.067400     -0.2352000    
 C    2.709500       1.191900      0.5427000    
 C    4.399900     -0.7632000     -0.5072000    
 C    4.043300       1.496000      0.2708000    
 C    2.572200      -2.449500     -0.5171000    
 C    1.828700       2.260800       1.104200    
 C    4.888600      0.5185000     -0.2543000    
 H   -1.419100     -0.5054000       1.456900    
 H  -0.8064000      -2.754900      0.6492000    
 H   -1.522900      -2.446000     -0.9232000    
 H   -2.987400      -2.667800       1.747300    
 H   -3.073700      -3.790800      0.3893000    
 H   -4.731700      4.8099998E-02 -0.1914000    
 H   -3.976800     -0.2199000       1.389100    
 H   -4.150800      -2.100800      -1.024000    
 H   -5.045600      -2.239100      0.4887000    
 H   -1.547000       1.914200     -0.3445000    
 H   -2.460000       1.705000       1.130700    
 H   -4.609500       1.984400     -0.1959000    
 H   -3.629900       2.121900      -1.680200    
 H   0.7376000     -0.8633000       1.454100    
 H   -4.218400       4.098300     -0.7435000    
 H    5.072200      -1.512300     -0.9171000    
 H    4.440500       2.489700      0.4607000    
 H    1.815800      -2.430700      -1.308500    
 H    3.379400      -3.111200     -0.8494000    
 H    2.140800      -2.896000      0.3851000    
 H    1.053100       2.533800      0.3813000    
 H    1.355300       1.923600       2.032400    
 H    2.392000       3.169500       1.343000    
 H    5.927100      0.7555000     -0.4665000    


%chk=000157187-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157187

0 1
O -0.325190 0.317337 -1.401770
O -2.467606 3.657987 0.514696
N -2.760797 -0.062057 0.289345
N 0.781206 -0.390941 0.540240
C -1.600300 -0.971253 0.283306
C -1.888726 -2.214620 -0.603521
C -3.187556 -2.926759 -0.169362
C -4.020650 -0.708637 0.718559
C -4.362759 -1.924685 -0.162785
C -2.532172 1.277516 0.883677
C -0.340935 -0.266717 -0.281113
C -2.755259 2.377223 -0.164099
C 2.126847 0.017139 0.224102
C 3.146043 -0.981417 0.272923
C 2.428076 1.376248 -0.080379
C 4.479673 -0.604492 -0.007162
C 3.776844 1.705183 -0.370999
C 2.806599 -2.425158 0.602336
C 1.370186 2.459454 -0.073483
C 4.795871 0.731171 -0.338240
H -1.368714 -1.337263 1.325778
H -1.026177 -2.907905 -0.551598
H -1.977847 -1.862015 -1.647557
H -3.060533 -3.353759 0.847573
H -3.399400 -3.772938 -0.849837
H -4.829189 0.042674 0.654823
H -3.966191 -1.040533 1.790503
H -4.557537 -1.575521 -1.194784
H -5.286420 -2.404422 0.214049
H -1.498877 1.373248 1.269559
H -3.206482 1.454236 1.747185
H -3.804830 2.349098 -0.526015
H -2.074553 2.200713 -1.018638
H 0.658522 -0.965749 1.378798
H -2.478609 4.389233 -0.151359
H 5.268216 -1.365466 0.021987
H 4.023948 2.745771 -0.611390
H 1.990434 -2.805117 -0.040390
H 3.685741 -3.075012 0.457968
H 2.480103 -2.551368 1.654854
H 0.718464 2.369428 -0.961367
H 0.710274 2.384124 0.810286
H 1.833852 3.460470 -0.070715
H 5.831109 1.011252 -0.562284


