%chk=000030358.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030358

1 1
 O   -1.384000      -2.319300     -0.4406000    
 O   0.6380000      -4.037800     -0.2349000    
 O   -2.754600     -0.9223000      0.9190000    
 O   -4.664500      0.9198000      0.6733000    
 N    3.153000       1.953200     -9.9999997E-05
 C    1.681000       1.524000      0.2858000    
 C    4.078400      0.9711000      0.7374000    
 C    1.405600      3.3100002E-02  0.1349000    
 C   0.6797000       2.343600     -0.5517000    
 C    3.898700     -0.4521000      0.2269000    
 C    2.463600     -0.8947000      0.1510000    
 C    3.424700       3.347400      0.5827000    
 C    3.492200       1.992600      -1.491300    
 C   5.8300000E-02 -0.4057000      4.7699999E-02
 C  -0.7419000       1.946600     -0.2192000    
 C   -1.037900      0.5937000      6.2700003E-02
 C    2.184600      -2.260700      3.2000002E-02
 C  -0.1792000      -1.786400     -6.9499999E-02
 C   0.8717000      -2.703300     -7.7699997E-02
 C   -1.757800       2.914200     -0.2435000    
 C   -2.373600      0.2668000      0.3583000    
 C   -3.378600       1.238600      0.3485000    
 C   -3.072200       2.559700      4.2800002E-02
 C   -1.592200      -2.527000      -1.833200    
 C   0.4233000      -4.800500      0.9501000    
 C   -5.516400      0.5054000     -0.3917000    
 H    1.524900       1.750400       1.351200    
 H    3.829300       1.037700       1.804100    
 H    5.112200       1.307900      0.5977000    
 H   0.8171000       2.174300      -1.626600    
 H   0.8071000       3.413700     -0.3602000    
 H    4.451100      -1.123300      0.8966000    
 H    4.349500     -0.5565000     -0.7673000    
 H    4.488500       3.570700      0.4546000    
 H    2.826100       4.084200      4.2599998E-02
 H    3.162300       3.338900       1.644500    
 H    3.155800       1.067300      -1.964400    
 H    2.988700       2.851100      -1.944600    
 H    4.575500       2.106800      -1.593800    
 H    2.999200      -2.981400      1.3600000E-02
 H   -1.526600       3.949400     -0.4808000    
 H   -3.848500       3.319600      3.5300002E-02
 H   -3.705200     -0.9022000       1.122200    
 H  -0.9969000      -3.368800      -2.198700    
 H   -1.354500      -1.624200      -2.405900    
 H   -2.649200      -2.762400      -1.986700    
 H  -0.4546000      -4.433000       1.490700    
 H    1.306000      -4.761700       1.596300    
 H   0.2463000      -5.840100      0.6614000    
 H   -6.494300      0.2556000      2.8800000E-02
 H   -5.112000     -0.3823000     -0.8887000    
 H   -5.643500       1.315700      -1.116400    


%chk=000030358-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030358

1 1
O -1.165149 -2.408982 -0.877183
O 1.080575 -4.162827 -0.292300
O -2.502321 -1.093177 1.021180
O -4.549645 0.523582 0.736258
N 3.056501 2.034797 0.062877
C 1.569370 1.550866 0.164637
C 3.897201 1.196465 1.053647
C 1.473148 0.022951 0.135576
C 0.668798 2.141411 -0.950840
C 3.966399 -0.269098 0.627115
C 2.589737 -0.830523 0.302559
C 3.152416 3.495443 0.487619
C 3.607806 1.888266 -1.351028
C 0.166768 -0.512898 -0.116030
C -0.764350 1.757904 -0.609670
C -0.986462 0.419308 -0.152416
C 2.413922 -2.228048 0.195164
C 0.044774 -1.907865 -0.375974
C 1.160630 -2.771972 -0.138114
C -1.818856 2.681416 -0.694979
C -2.271719 0.092421 0.344024
C -3.344390 1.032779 0.228354
C -3.132744 2.313065 -0.306077
C -1.060043 -3.058543 -2.213507
C 0.027886 -4.852730 0.504343
C -5.744502 1.375412 0.675135
H 1.226273 1.952443 1.141435
H 3.398286 1.301724 2.032814
H 4.896347 1.662588 1.105691
H 0.964515 1.712794 -1.928682
H 0.745861 3.241179 -1.014935
H 4.414011 -0.833888 1.466391
H 4.664249 -0.398923 -0.222931
H 4.193075 3.833843 0.364925
H 2.489762 4.108681 -0.138598
H 2.853937 3.584344 1.543251
H 3.386170 0.880025 -1.726206
H 3.135973 2.638298 -2.001008
H 4.696064 2.055448 -1.321766
H 3.246029 -2.919559 0.363685
H -1.632129 3.696107 -1.062243
H -3.950774 3.033805 -0.389486
H -3.470499 -1.144052 1.250332
H -0.326337 -3.883253 -2.201600
H -0.777460 -2.305465 -2.971831
H -2.069698 -3.441199 -2.421150
H -0.964697 -4.406115 0.324109
H 0.283139 -4.791793 1.577529
H 0.056228 -5.898775 0.167433
H -6.554118 0.771279 1.107606
H -5.985687 1.633842 -0.372514
H -5.600072 2.294597 1.272579


