%chk=000059195.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059195

0 1
 O    4.299500     -0.2882000      1.3300000E-02
 O   -4.299500      0.2879000      1.2900000E-02
 O    5.384900      -2.317100     -5.6200001E-02
 O   -5.384600       2.317100     -5.6100000E-02
 N    7.698900       1.882100      3.4100000E-02
 N   -7.699100      -1.881800      3.3900000E-02
 C   0.5503000     -0.5315000      3.6200002E-02
 C  -0.5503000      0.5308000      3.5700001E-02
 C    1.937900      0.1060000      5.3199999E-02
 C   -1.938000     -0.1066000      5.2600000E-02
 C    3.039100     -0.9441000      1.0700000E-02
 C   -3.039000      0.9437000      1.0300000E-02
 C    5.395300      -1.096300     -2.2600001E-02
 C   -5.395200       1.096300     -2.2600001E-02
 C    6.643600     -0.2925000     -1.4300000E-02
 C   -6.643500      0.2926000     -1.4300000E-02
 C    7.891300     -0.9054000     -4.5100000E-02
 C   -7.891200      0.9058000     -4.4799998E-02
 C    6.601900       1.091900      2.4499999E-02
 C   -6.602100      -1.091800      2.4200000E-02
 C    9.042900     -0.1263000     -3.6300000E-02
 C   -9.042900      0.1268000     -3.5999998E-02
 C    8.894000       1.250700      3.1999999E-03
 C   -8.894100      -1.250200      3.4000000E-03
 H   0.4353000      -1.181400      0.9122000    
 H   0.4465000      -1.165600     -0.8527000    
 H  -0.4463000       1.164400     -0.8535000    
 H  -0.4355000       1.181100      0.9114000    
 H    2.053800      0.7857000     -0.8003000    
 H    2.060600      0.7268000      0.9495000    
 H   -2.054000     -0.7862000     -0.8010000    
 H   -2.060700     -0.7275000      0.9488000    
 H    2.966300      -1.599500      0.8866000    
 H    2.945600      -1.549300     -0.8988000    
 H   -2.966100       1.599000      0.8863000    
 H   -2.945500       1.549000     -0.8991000    
 H    7.985500      -1.987400     -7.5999998E-02
 H   -7.985300       1.987800     -7.5599998E-02
 H    5.672300       1.651300      5.0299998E-02
 H   -5.672600      -1.651300      4.9800001E-02
 H    10.02600     -0.5822000     -5.9900001E-02
 H   -10.02600      0.5829000     -5.9400000E-02
 H    9.761000       1.903000      1.1600000E-02
 H   -9.761300      -1.902400      1.1900000E-02


%chk=000059195-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059195

0 1
O 4.378969 -0.233196 0.006856
O -4.378982 0.233108 0.007048
O 5.468953 -2.294669 -0.008619
O -5.468963 2.294583 -0.008423
N 7.925200 1.927771 0.019228
N -7.925217 -1.927854 0.019138
C 0.563885 -0.527925 0.006610
C -0.563898 0.527833 0.006534
C 1.972916 0.110019 0.007496
C -1.972930 -0.110110 0.007627
C 3.069970 -0.953634 0.003759
C -3.069982 0.953543 0.003790
C 5.516454 -1.039005 -0.000113
C -5.516467 1.038921 0.000274
C 6.773849 -0.235299 0.004116
C -6.773862 0.235215 0.004303
C 8.016799 -0.917935 -0.002821
C -8.016812 0.917853 -0.002728
C 6.780419 1.185027 0.015085
C -6.780436 -1.185111 0.015162
C 9.206667 -0.162943 0.001312
C -9.206680 0.162862 0.001226
C 9.113238 1.249533 0.012320
C -9.113254 -1.249615 0.012156
H 0.450981 -1.183421 0.894769
H 0.451631 -1.182588 -0.882257
H -0.451693 1.182313 -0.882474
H -0.450946 1.183511 0.894552
H 2.093356 0.759824 -0.880547
H 2.094489 0.754787 0.899035
H -2.093432 -0.760066 -0.880297
H -2.094442 -0.754727 0.899284
H 3.029279 -1.604976 0.896678
H 3.029642 -1.598417 -0.893893
H -3.029249 1.605017 0.896610
H -3.029696 1.598194 -0.893959
H 8.022422 -2.012745 -0.011142
H -8.022432 2.012664 -0.010977
H 5.838156 1.740462 0.020696
H -5.838173 -1.740547 0.020851
H 10.186252 -0.650264 -0.003793
H -10.186264 0.650185 -0.003958
H 10.015096 1.872383 0.015902
H -10.015113 -1.872464 0.015582


