%chk=000057940.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057940

0 1
 N   -1.937300     -0.2717000      3.2699998E-02
 C   -1.409100      0.9701000      0.5982000    
 C   0.1200000      0.8903000      0.7624000    
 C   0.9058000      0.7544000     -0.5499000    
 C   -1.788600       2.144800     -0.3039000    
 C   -3.387900     -0.1829000     -0.1280000    
 C   -1.585100      -1.409300      0.8812000    
 C    2.394000      0.7418000     -0.3387000    
 C   -3.947000      -1.441000     -0.7705000    
 C    3.199600     -0.3194000     -0.1438000    
 C    4.682000     -0.1246000      3.7000000E-02
 C    2.753600      -1.752300     -7.6700002E-02
 H   -1.837800       1.153000       1.593600    
 H   0.4213000      0.1181000       1.478600    
 H   0.4426000       1.826500       1.242500    
 H   0.6816000       1.592000      -1.220600    
 H   0.5954000     -0.1472000      -1.088800    
 H   -2.831500       2.448600     -0.1620000    
 H   -1.186600       3.028200     -5.9999999E-02
 H   -1.634300       1.927500      -1.367000    
 H   -3.897100      3.3000000E-03  0.8260000    
 H   -3.661500      0.6265000     -0.8118000    
 H  -0.5070000      -1.584900      0.9193000    
 H   -1.966100      -2.355400      0.4845000    
 H   -1.958900      -1.296400       1.905500    
 H    2.848200       1.732200     -0.3454000    
 H   -3.367200      -1.741700      -1.650100    
 H   -3.998800      -2.281800     -7.2200000E-02
 H   -4.973800      -1.255200      -1.106400    
 H    5.232300     -0.6623000     -0.7421000    
 H    4.998200     -0.5069000       1.013200    
 H    4.975300      0.9290000     -1.7300000E-02
 H    3.031700      -2.189300      0.8880000    
 H    1.673200      -1.869100     -0.1876000    
 H    3.232000      -2.334300     -0.8712000    


%chk=000057940-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057940

0 1
N -1.964527 -0.242405 0.169198
C -1.466424 1.111536 0.590980
C 0.071382 1.103574 0.826540
C 0.903640 0.665282 -0.409367
C -1.842442 2.206629 -0.438110
C -3.418491 -0.242194 -0.159190
C -1.637678 -1.283791 1.171253
C 2.390041 0.654668 -0.119624
C -3.919988 -1.569690 -0.760420
C 3.258328 -0.396590 -0.190573
C 4.731647 -0.215727 0.144558
C 2.874728 -1.808210 -0.601220
H -1.939564 1.390828 1.573057
H 0.330688 0.454434 1.683585
H 0.367160 2.129054 1.127362
H 0.701041 1.372164 -1.240340
H 0.538639 -0.318489 -0.751224
H -2.910972 2.479511 -0.396210
H -1.262669 3.123764 -0.229356
H -1.607493 1.875397 -1.465532
H -4.039253 0.016963 0.740608
H -3.592834 0.549960 -0.905762
H -0.545949 -1.381286 1.285691
H -2.017007 -2.261287 0.833353
H -2.074924 -1.070269 2.181218
H 2.804214 1.627441 0.195439
H -3.263660 -1.881416 -1.592855
H -3.959050 -2.389494 -0.021805
H -4.943602 -1.436221 -1.156543
H 5.372330 -0.474552 -0.722609
H 5.037726 -0.885489 0.973448
H 4.960505 0.823046 0.440574
H 3.141881 -2.531969 0.194883
H 1.799390 -1.917827 -0.815170
H 3.434387 -2.116743 -1.507136


