%chk=000059958.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059958

0 1
 O   -1.304500     -0.1207000     -0.1170000    
 O  -0.6496000      -2.230900     -0.7071000    
 O    3.257000      0.6061000      0.9196000    
 N   -5.536200     -3.8999999E-03 -1.8999999E-02
 N   0.8699000     -0.6381000      8.9299999E-02
 C   -2.645500     -0.4466000     -0.4600000    
 C   -3.369000      -1.021500      0.7552000    
 C   -3.349800      0.8110000     -0.9602000    
 C   -4.860500      -1.211800      0.4740000    
 C   -4.841700      0.5591000      -1.184800    
 C   -5.736500      0.9866000       1.036200    
 C   -6.569500       2.156400      0.5402000    
 C  -0.3711000      -1.114900     -0.2859000    
 C    2.106000      -1.323400      7.5999998E-02
 C    3.276200     -0.6879000      0.4915000    
 C    3.407700       2.914800      0.2878000    
 C    4.053800       1.539800      0.1942000    
 C    4.202900       3.964700     -0.4830000    
 C    2.148400      -2.648300     -0.3582000    
 C    4.488700      -1.377500      0.4728000    
 C    3.360900      -3.337700     -0.3770000    
 C    3.531400       5.327300     -0.4229000    
 C    4.531000      -2.702400      3.8400002E-02
 H   -2.669900      -1.178700      -1.278600    
 H   -2.921300      -1.983000       1.034000    
 H   -3.219400     -0.3679000       1.623700    
 H   -3.198900       1.635200     -0.2518000    
 H   -2.883000       1.141900      -1.896200    
 H   -5.362200      -1.588600       1.373800    
 H   -4.980300      -2.002900     -0.2779000    
 H   -4.943100     -0.1644000      -2.005800    
 H   -5.324000       1.462000      -1.571000    
 H   -4.795400       1.360500       1.454400    
 H   -6.287200      0.5188000       1.861900    
 H   -5.998800       2.834000     -0.1018000    
 H   -7.461200       1.820500      9.9999997E-05
 H   -6.911200       2.750100       1.395500    
 H   0.9050000      0.3247000      0.4157000    
 H    2.381600       2.858200     -9.7199999E-02
 H    3.316300       3.204300       1.342000    
 H    4.136700       1.243200     -0.8595000    
 H    5.057900       1.563500      0.6327000    
 H    4.302900       3.661500      -1.531700    
 H    5.215300       4.042200     -6.9799997E-02
 H    1.288300      -3.209400     -0.6948000    
 H    5.407400     -0.8994000      0.8017000    
 H    3.442400       5.675300      0.6112000    
 H    4.118400       6.064100     -0.9801000    
 H    2.528800       5.290400     -0.8608000    
 H    3.395200      -4.369700     -0.7144000    
 H    5.474600      -3.239900      2.5699999E-02


%chk=000059958-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059958

0 1
O -1.386029 -0.214778 -0.441779
O -0.789183 -2.500467 -0.431118
O 2.955941 0.739595 -0.130553
N -5.665669 -0.031562 0.147392
N 0.801463 -0.749833 -0.283415
C -2.831288 -0.600130 -0.531653
C -3.391140 -0.940295 0.860125
C -3.564443 0.591883 -1.157602
C -4.930182 -1.173440 0.746126
C -5.099054 0.300988 -1.183794
C -5.850009 1.125720 1.061842
C -6.997705 2.052648 0.617198
C -0.469198 -1.283447 -0.385917
C 2.026624 -1.454060 -0.196939
C 3.204786 -0.648557 -0.110370
C 3.567517 3.083032 -0.097063
C 4.109140 1.653260 -0.040727
C 4.695704 4.134256 0.026200
C 2.149310 -2.862602 -0.188360
C 4.477854 -1.243558 -0.015014
C 3.430150 -3.455276 -0.093027
C 4.159800 5.580228 -0.044181
C 4.588733 -2.655421 -0.006297
H -2.895711 -1.493823 -1.184004
H -2.896665 -1.844780 1.257864
H -3.184284 -0.100168 1.550670
H -3.357004 1.500794 -0.561031
H -3.193178 0.774867 -2.183077
H -5.355517 -1.391068 1.742407
H -5.109943 -2.065046 0.111245
H -5.291136 -0.558642 -1.857400
H -5.638859 1.165454 -1.606593
H -4.919585 1.732209 1.194207
H -6.095107 0.710390 2.058182
H -6.780981 2.548077 -0.346755
H -7.929632 1.472413 0.502312
H -7.162351 2.847476 1.368369
H 0.875993 0.271792 -0.270747
H 3.022520 3.226686 -1.049821
H 2.833575 3.222665 0.720043
H 4.800612 1.454888 -0.885932
H 4.649175 1.467832 0.911209
H 5.439496 3.976830 -0.781451
H 5.235845 3.986036 0.983356
H 1.245316 -3.471244 -0.257257
H 5.378563 -0.626609 0.051682
H 3.439073 5.776272 0.771552
H 4.978619 6.317111 0.043118
H 3.639756 5.763590 -1.002950
H 3.514848 -4.547018 -0.087097
H 5.578342 -3.118467 0.067924


