%chk=000011382.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011382

0 1
 O    7.197600     -0.2418000      1.6700000E-02
 O   -7.192400      0.2379000     -1.2200000E-02
 N    1.092700      -1.568400      6.3500002E-02
 N   -1.102400       1.572200     -6.4999998E-02
 C    3.116900      0.5159000     -2.7400000E-02
 C   -3.127200     -0.5136000      2.5599999E-02
 C    1.687000      0.7802000     -4.2700000E-02
 C   -1.680900     -0.7798000      3.9000001E-02
 C   0.7072000     -0.1548000      9.1000004E-03
 C  -0.7172000      0.1584000     -1.2900000E-02
 C    3.807400      0.4841000       1.184300    
 C   -3.790900     -0.2970000       1.223800    
 C    3.797900      0.2930000      -1.224100    
 C   -3.802800     -0.4825000      -1.184900    
 C    5.178800      0.2297000       1.199100    
 C   -5.162500     -4.3800000E-02   1.211200    
 C    5.169300      3.8400002E-02  -1.209200    
 C   -5.174400     -0.2290000      -1.197600    
 C    5.859700      6.8999999E-03  2.4000001E-03
 C   -5.854400     -9.8000001E-03  5.0000002E-04
 C    1.397300      -2.684400      0.1064000    
 C   -1.406700       2.688300     -0.1058000    
 H    1.446500       1.838600     -9.3699999E-02
 H   -1.443300      -1.838600      8.8900000E-02
 H    3.290500      0.6558000       2.125500    
 H   -3.263400     -0.3210000       2.173800    
 H    3.274000      0.3144000      -2.176700    
 H   -3.284500     -0.6519000      -2.125100    
 H    5.705100      0.2076000       2.149700    
 H   -5.686600      0.1265000       2.147800    
 H    5.694200     -0.1347000      -2.144700    
 H   -5.701700     -0.2049000      -2.147500    
 H    7.511100     -0.2265000      0.9374000    
 H   -7.506700      0.2246000     -0.9325000    


%chk=000011382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000011382

0 1
O 7.461722 -0.070837 -0.079351
O -7.459527 0.070638 0.080930
N 0.840976 -0.984275 -1.302628
N -0.838570 0.981642 1.302893
C 3.232698 0.207085 0.281547
C -3.230748 -0.207280 -0.282160
C 1.795675 0.361790 0.484653
C -1.793839 -0.362080 -0.485767
C 0.703698 -0.148702 -0.195149
C -0.701668 0.147348 0.194508
C 4.085300 0.889941 1.205092
C -3.861490 0.560030 0.750532
C 3.864031 -0.559577 -0.751289
C -4.083761 -0.890557 -1.204996
C 5.485134 0.820828 1.116976
C -5.259028 0.635527 0.848486
C 5.261619 -0.635058 -0.848481
C -5.483572 -0.821479 -1.116100
C 6.077195 0.052775 0.082844
C -6.075030 -0.053010 -0.081956
C 0.907152 -1.711137 -2.265079
C -0.904278 1.707406 2.266220
H 1.531566 1.000898 1.335491
H -1.530087 -1.000725 -1.337027
H 3.631391 1.485238 2.006471
H -3.263312 1.101987 1.483801
H 3.266315 -1.100811 -1.485461
H -3.630314 -1.486204 -2.006360
H 6.110148 1.356891 1.842435
H -5.739643 1.221528 1.637100
H 5.742625 -1.220557 -1.637241
H -6.109050 -1.357784 -1.840980
H 7.952326 0.439528 0.612373
H -7.950453 -0.441004 -0.609625


