%chk=000153107.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153107

1 1
 O   -4.670900     -0.6835000      0.7161000    
 O   -4.687200      -1.322300      -1.535900    
 N  -0.2069000       2.487800     -0.2191000    
 N    4.697700      -1.630800      1.7800000E-02
 C   0.8161000       1.598200      0.4639000    
 C   0.2307000      0.1949000      0.3801000    
 C    2.248600       1.733800     -1.8100001E-02
 C   -1.219300      0.4125000      0.3218000    
 C   -1.448100       1.744300     -4.2100001E-02
 C   0.9795000     -0.9122000      0.2215000    
 C    3.035600      0.6352000     -0.1452000    
 C    2.438400     -0.7130000      0.1321000    
 C    2.698400       3.162000     -0.2112000    
 C   -2.301300     -0.4087000      0.5941000    
 C   -2.714600       2.283200     -0.1828000    
 C   0.4351000      -2.295800     -1.1400000E-02
 C    3.318700      -1.739300      0.2140000    
 C    4.456900      0.7087000     -0.5077000    
 C   -3.594500      0.1118000      0.4569000    
 C   -3.799300       1.445000      6.6200003E-02
 C    5.202900     -0.4021000     -0.3932000    
 C    5.560700      -2.804400      0.1032000    
 C   -5.149000      -1.381400     -0.4040000    
 C   -6.328100      -2.223900     -1.7100001E-02
 H   0.7955000       1.913400       1.518900    
 H  -2.5400000E-02   2.594700      -1.226300    
 H  -0.2747000       3.418900      0.2119000    
 H    3.781400       3.284300     -0.2675000    
 H    2.366000       3.778100      0.6319000    
 H    2.266600       3.572700      -1.129500    
 H   -2.168900      -1.431500      0.9300000    
 H   -2.865100       3.318300     -0.4672000    
 H   0.5226000      -2.899700      0.8975000    
 H   0.9733000      -2.801500     -0.8214000    
 H  -0.6101000      -2.297100     -0.3246000    
 H    3.012800      -2.760200      0.4152000    
 H    4.912000       1.628200     -0.8504000    
 H   -4.809700       1.834100     -3.1599998E-02
 H    6.260700     -0.4032000     -0.6310000    
 H    6.587000      -2.526100      0.3681000    
 H    5.581300      -3.327800     -0.8585000    
 H    5.206600      -3.501800      0.8708000    
 H   -6.029700      -2.948900      0.7441000    
 H   -6.689300      -2.767500     -0.8948000    
 H   -7.132700      -1.584400      0.3538000    


%chk=000153107-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000153107

1 1
O -4.446552 -0.661444 0.613653
O -3.120539 -2.608251 0.601579
N -0.914391 3.041054 -1.801463
N 4.323755 -1.911524 -0.009560
C 1.004551 1.880893 0.318664
C 0.262938 0.793256 -0.268310
C 2.356759 1.808204 0.674103
C -1.202761 0.981684 -0.463044
C -1.739071 2.118453 -1.156804
C 0.918942 -0.433278 -0.547865
C 3.032311 0.563893 0.439100
C 2.307208 -0.547680 -0.165264
C 3.062612 2.988291 1.311323
C -2.088436 0.036360 0.121391
C -3.155225 2.286723 -1.202338
C 0.214347 -1.582937 -1.244952
C 3.013389 -1.765538 -0.357001
C 4.406463 0.358600 0.783896
C -3.479114 0.210230 0.030114
C -4.016355 1.347345 -0.618602
C 5.033096 -0.857103 0.558364
C 5.028939 -3.210191 -0.219302
C -4.206208 -2.041191 0.844808
C -5.454459 -2.671422 1.410385
H 0.456303 2.806393 0.527511
H 0.070480 2.849075 -1.963215
H -1.325848 3.832089 -2.291425
H 3.442908 2.744367 2.320951
H 2.377191 3.843773 1.418153
H 3.924568 3.328576 0.707196
H -1.681769 -0.819019 0.660765
H -3.576176 3.156123 -1.719623
H -0.088527 -2.383800 -0.543077
H 0.849079 -2.036995 -2.027578
H -0.709485 -1.235308 -1.730043
H 2.527228 -2.644861 -0.781613
H 4.988317 1.164615 1.235878
H -5.101892 1.475146 -0.660736
H 6.077320 -1.051121 0.807987
H 5.362942 -3.611202 0.751194
H 5.900189 -3.056169 -0.875966
H 4.346184 -3.931110 -0.690978
H -5.797574 -2.113792 2.298258
H -5.254306 -3.718704 1.676804
H -6.269030 -2.629501 0.665982


