%chk=000044708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044708

0 1
 N    3.387300     -0.1778000      0.3743000    
 C  -5.7999999E-03   1.065400     -0.8005000    
 C  -0.1192000       2.234800      0.2124000    
 C    1.490600      0.6843000     -0.8748000    
 C  -0.8734000     -0.1297000     -0.3860000    
 C   -1.557600       2.502000      0.6308000    
 C   -2.121300       1.281600       1.343800    
 C   -1.876100     -6.6000000E-03  0.5998000    
 C  -0.4571000       1.543800      -2.197800    
 C    1.972200      0.1610000      0.4659000    
 C  -0.7174000      -1.377300      -1.022300    
 C   -2.653100      -1.124900      0.9509000    
 C   -1.504200      -2.476000     -0.6727000    
 C   -2.469200      -2.351200      0.3177000    
 C    3.602000      -1.230800     -0.6200000    
 C    3.902300     -0.5987000       1.678400    
 H   0.3072000       3.148300     -0.2217000    
 H   0.4210000       2.069800       1.145200    
 H    2.081600       1.565500      -1.162300    
 H    1.626300     -4.3499999E-02  -1.679900    
 H   -2.172100       2.749200     -0.2424000    
 H   -1.600300       3.369500       1.299500    
 H   -3.197800       1.429900       1.491400    
 H   -1.661900       1.193400       2.336500    
 H   9.9799998E-02   2.434400      -2.510400    
 H  -0.2932000      0.7737000      -2.961000    
 H   -1.524000       1.791500      -2.220100    
 H    1.397500     -0.7092000      0.8028000    
 H    1.897400      0.9187000       1.246200    
 H   1.6899999E-02  -1.512600      -1.811900    
 H   -3.412700      -1.040700       1.724800    
 H   -1.361500      -3.427300      -1.176900    
 H   -3.080200      -3.204800      0.5954000    
 H    3.508200     -0.8559000      -1.643400    
 H    2.928700      -2.084500     -0.4810000    
 H    4.630100      -1.609100     -0.5579000    
 H    3.777200      0.1981000       2.420200    
 H    4.977600     -0.8022000       1.621000    
 H    3.399900      -1.499200       2.050400    


%chk=000044708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044708

0 1
N 3.475296 -0.216660 0.412290
C -0.048311 1.050640 -0.787565
C -0.171643 2.276355 0.169744
C 1.452417 0.599405 -0.851577
C -0.975549 -0.109865 -0.351891
C -1.621320 2.556414 0.613498
C -2.153870 1.352066 1.413947
C -1.966918 0.037820 0.662314
C -0.462023 1.499124 -2.224664
C 1.992580 -0.102639 0.412345
C -0.868672 -1.364980 -1.010486
C -2.802880 -1.063594 0.984307
C -1.700749 -2.453809 -0.683204
C -2.678988 -2.304181 0.327523
C 3.987802 -1.107548 -0.649153
C 3.988840 -0.610765 1.740489
H 0.257938 3.159700 -0.341655
H 0.439829 2.109307 1.078837
H 2.073662 1.499358 -1.032550
H 1.587557 -0.058459 -1.732119
H -2.266065 2.735219 -0.268896
H -1.659838 3.472540 1.233131
H -3.223487 1.487503 1.664382
H -1.612864 1.301043 2.382893
H 0.236005 2.271807 -2.600052
H -0.444081 0.648239 -2.929435
H -1.483879 1.918989 -2.237251
H 1.505137 -1.103959 0.526257
H 1.715358 0.488337 1.306064
H -0.114896 -1.493965 -1.796628
H -3.566837 -0.935965 1.762367
H -1.589881 -3.408213 -1.210369
H -3.337521 -3.139128 0.592360
H 3.708573 -0.721130 -1.643786
H 3.604927 -2.158096 -0.563518
H 5.091030 -1.140601 -0.599571
H 3.654938 0.119421 2.499582
H 5.093946 -0.609130 1.728036
H 3.650137 -1.627699 2.068401


