%chk=000093617.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093617

0 1
 O    2.852000       2.576300     -0.1212000    
 O   7.8699999E-02  -1.254900      5.1199999E-02
 O    4.715100      -1.686100      6.6799998E-02
 N    3.800400      0.4465000     -2.0500001E-02
 N    2.396500      -1.488300      0.1029000    
 N   -5.012600     -0.4061000      5.1000002E-03
 C    1.398300      0.7111000     -3.2400001E-02
 C   -1.035200       1.015400     -5.7000000E-02
 C    2.733000       1.353800     -6.2399998E-02
 C    1.202500     -0.7547000      4.5800000E-02
 C   0.3113000       1.496600     -7.8299999E-02
 C    3.710100     -0.9664000      5.4499999E-02
 C   -3.684800      6.8200000E-02 -1.5200000E-02
 C   -1.698500      0.6735000      -1.250000    
 C   -1.731200      0.8713000       1.157500    
 C   -3.011800      0.2040000      -1.229300    
 C   -3.044500      0.4018000       1.178300    
 C    5.154400      0.9937000     -5.9999999E-02
 C    2.270600      -2.938800      0.2248000    
 C   -5.478700      -1.327800      -1.012100    
 C   -5.925400      1.0700000E-02   1.051300    
 H   0.4005000       2.578500     -0.1342000    
 H   -1.191700      0.7754000      -2.207600    
 H   -1.248000       1.123800       2.099300    
 H   -3.485200     -3.5500001E-02  -2.177200    
 H   -3.535400      0.2963000       2.141500    
 H    5.667800      0.5969000     -0.9418000    
 H    5.695600      0.6614000      0.8319000    
 H    5.164900       2.085400     -9.9900000E-02
 H    1.262600      -3.247300      0.5131000    
 H    2.982700      -3.309200      0.9691000    
 H    2.520500      -3.383600     -0.7437000    
 H   -4.730800      -2.099400      -1.227300    
 H   -5.720900     -0.7945000      -1.937400    
 H   -6.385300      -1.850400     -0.6868000    
 H   -5.828600       1.081100       1.265500    
 H   -5.747300     -0.5571000       1.970600    
 H   -6.967300     -0.1578000      0.7566000    


%chk=000093617-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093617

0 1
O 2.510054 2.161292 1.024700
O 0.778325 -2.001829 -0.789581
O 5.353089 -1.217247 -0.460059
N 3.920581 0.468338 0.282059
N 3.052177 -1.581594 -0.610680
N -5.433947 -0.065408 0.054525
C 1.461382 0.143877 0.145054
C -1.180658 0.429143 0.271199
C 2.626855 1.002188 0.517928
C 1.691311 -1.189016 -0.436883
C 0.221234 0.744584 0.408658
C 4.175332 -0.800208 -0.273390
C -4.057822 0.098861 0.126664
C -1.772368 -0.771034 -0.251388
C -2.092221 1.451207 0.716425
C -3.157975 -0.928823 -0.320691
C -3.477615 1.304566 0.652379
C 5.109477 1.278528 0.633095
C 3.345297 -2.911613 -1.193361
C -6.006196 -1.309804 -0.487616
C -6.336226 0.998652 0.526234
H 0.385098 1.744416 0.844858
H -1.104928 -1.564293 -0.596742
H -1.678241 2.382733 1.122718
H -3.553625 -1.863509 -0.727455
H -4.114961 2.118779 1.006832
H 5.729473 1.445411 -0.262574
H 5.719540 0.749241 1.383166
H 4.744728 2.233551 1.036112
H 2.382669 -3.410485 -1.370614
H 3.966609 -3.498150 -0.497518
H 3.899999 -2.796501 -2.139093
H -5.702674 -2.191619 0.109685
H -5.692324 -1.478142 -1.536099
H -7.104767 -1.245845 -0.467141
H -6.186600 1.939592 -0.038540
H -6.185216 1.213128 1.602391
H -7.380566 0.680834 0.386242


