%chk=000130111.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130111

0 1
 O    1.078700      -1.638100      -1.815700    
 N   -1.233900      -2.087600       1.459900    
 C   0.9786000      -2.039500      0.5361000    
 C    4.638400       1.151100      0.3318000    
 C    2.464900      -2.158000      0.5630000    
 C    3.903800       2.370500     -0.2387000    
 C    3.985100     -0.1727000     -3.9999999E-04
 C   0.1373000      -2.187600       1.584800    
 C    3.119000     -0.8280000      0.7974000    
 C   -1.097400      -1.665100     -0.9196000    
 C   0.3782000      -1.772200     -0.8187000    
 C   -1.864600      -1.828800      0.2408000    
 C    1.351700       2.694100     -0.2431000    
 C   1.9900000E-02   2.829200      0.4683000    
 C    2.544800       2.573900      0.3729000    
 C  -0.9794000       1.683800      0.2466000    
 C    4.406200     -0.7792000      -1.315000    
 C   0.6115000      -2.440100       2.993600    
 C   -1.708000      -1.406700      -2.150500    
 C   -3.257300      -1.729500      0.1533000    
 C    1.291200       2.625600      -1.749000    
 C   -2.226800       1.792100       1.078700    
 C   -3.097100      -1.310200      -2.222800    
 C   -3.870400      -1.471000      -1.073900    
 C   -3.396000       2.362700      0.7320000    
 C   -3.567700       2.992100     -0.6245000    
 C   -4.610700       2.438900       1.612400    
 H    5.672800       1.145700     -3.4600001E-02
 H    4.716500       1.253300       1.422700    
 H    2.779700      -2.826600       1.373600    
 H    2.819500      -2.678800     -0.3293000    
 H    3.867100       2.283000      -1.327800    
 H    4.501400       3.264600     -2.1500001E-02
 H    2.870400     -0.3555000       1.747700    
 H  -0.4391000       3.776400      0.1555000    
 H   0.1989000       2.932200       1.547300    
 H    2.546000       2.623200       1.461600    
 H   -1.800800      -2.201400       2.290600    
 H  -0.4805000      0.7527000      0.5323000    
 H   -1.216200       1.573200     -0.8165000    
 H    4.411000     -8.1000002E-03  -2.093900    
 H    5.423200      -1.176500      -1.231400    
 H    3.761100      -1.572000      -1.692000    
 H   0.1076000      -1.759500       3.689700    
 H   0.3750000      -3.467500       3.289800    
 H    1.683500      -2.284700       3.133500    
 H   -1.122400      -1.277000      -3.056100    
 H   -3.874600      -1.850700       1.040000    
 H    1.202100       1.586000      -2.080400    
 H    2.154100       3.089100      -2.234500    
 H   0.4162000       3.173100      -2.117700    
 H   -2.148500       1.363200       2.076600    
 H   -3.577700      -1.108000      -3.175600    
 H   -4.952200      -1.393400      -1.133100    
 H   -4.253300       2.390700      -1.230700    
 H   -2.639900       3.116400      -1.187000    
 H   -3.998100       3.994300     -0.5176000    
 H   -4.438200       1.955800       2.579700    
 H   -4.881000       3.482400       1.802700    
 H   -5.458900       1.937700       1.135100    


%chk=000130111-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130111

0 1
O 1.451251 -2.342671 -2.052886
N -1.418440 -1.694958 0.855944
C 0.910433 -2.056019 0.288739
C 4.537038 1.154899 0.450696
C 2.387140 -2.175871 0.648376
C 3.924182 2.388332 -0.302664
C 3.922525 -0.183548 0.052970
C -0.083746 -1.833062 1.238867
C 3.059887 -0.827647 0.891620
C -0.872381 -1.998515 -1.488686
C 0.564738 -2.147632 -1.141585
C -1.845851 -1.766563 -0.471954
C 1.339518 2.610955 -0.301531
C 0.094239 3.086629 0.442290
C 2.575365 2.803854 0.245735
C -0.836973 1.916182 0.900927
C 4.350948 -0.727430 -1.302191
C 0.160534 -1.687287 2.725014
C -1.302401 -2.080265 -2.840351
C -3.220789 -1.615840 -0.806924
C 1.087408 1.922044 -1.630904
C -1.953207 2.394259 1.806742
C -2.657614 -1.935706 -3.175340
C -3.618195 -1.701358 -2.150266
C -3.287076 2.492859 1.527896
C -3.925043 2.100831 0.205809
C -4.259913 3.047332 2.558620
H 5.625337 1.129895 0.232005
H 4.429480 1.319620 1.540447
H 2.512373 -2.810733 1.548170
H 2.879125 -2.698005 -0.188633
H 3.869506 2.164816 -1.383991
H 4.631359 3.235860 -0.192993
H 2.810319 -0.336310 1.845660
H -0.504312 3.765298 -0.200392
H 0.391737 3.670554 1.335202
H 2.618131 3.306737 1.226511
H -2.111783 -1.489575 1.578005
H -0.202755 1.185523 1.443415
H -1.234900 1.390677 0.014764
H 4.492659 0.098113 -2.025738
H 5.326818 -1.248639 -1.224128
H 3.611140 -1.424703 -1.729577
H 0.164644 -0.620694 3.022299
H -0.624851 -2.197240 3.314340
H 1.131898 -2.115137 3.011869
H -0.532687 -2.259643 -3.598224
H -3.960885 -1.434641 -0.017416
H 0.579178 0.949194 -1.485521
H 2.014887 1.716013 -2.188565
H 0.426202 2.537952 -2.272276
H -1.621839 2.741686 2.799408
H -2.980122 -2.002085 -4.219509
H -4.676632 -1.586769 -2.409144
H -4.762212 1.392148 0.368555
H -3.217860 1.635730 -0.499337
H -4.363436 2.989956 -0.290398
H -3.750604 3.321573 3.498963
H -4.774294 3.950030 2.171954
H -5.054501 2.311993 2.797711


