%chk=000091875.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091875

0 1
 O  -0.5903000     -1.7200001E-02   1.957300    
 O    2.996500      6.3400000E-02 -0.2940000    
 O    2.215500      0.3208000       1.850800    
 N   0.7869000     -0.1555000      7.5000003E-02
 C   -1.581300     -0.5201000     -0.1687000    
 C   -2.892500     -0.5747000      0.6391000    
 C   -1.597300      0.4642000      -1.358100    
 C   -1.288300      -1.934900     -0.7071000    
 C   -3.471800      0.7639000       1.102700    
 C   -1.713800       1.943500     -0.9870000    
 C   -4.100000       1.557100     -3.7799999E-02
 C   -3.137200       2.456600     -0.8035000    
 C  -0.4293000     -0.1969000      0.7533000    
 C   -1.174500      -2.921700      0.4469000    
 C   -2.375600      -2.359300      -1.685000    
 C    2.019400      9.8200001E-02  0.6606000    
 C    4.329500      0.3092000      0.1681000    
 C    5.282000      0.2333000      -1.015300    
 C    6.722100      0.4699000     -0.5973000    
 H   -2.754500      -1.163900       1.554700    
 H   -3.695000      -1.073000      9.0899996E-02
 H   -2.438600      0.2476000      -2.025900    
 H  -0.7051000      0.3458000      -1.984200    
 H  -0.3430000      -1.970300      -1.262100    
 H   -2.738300       1.367300       1.647200    
 H   -4.269600      0.5370000       1.822400    
 H   -1.256100       2.537000      -1.789500    
 H   -1.124300       2.169900     -9.1700003E-02
 H   -4.896100       2.193300      0.3698000    
 H   -4.598700      0.8759000     -0.7386000    
 H   -3.575000       2.665000      -1.788200    
 H   -3.080200       3.428300     -0.2960000    
 H  -0.8574000      -3.896000      5.3199999E-02
 H  -0.4267000      -2.645600       1.195000    
 H   -2.127800      -3.106100      0.9516000    
 H   -3.366100      -2.482700      -1.242600    
 H   -2.117900      -3.350200      -2.083000    
 H   -2.452600      -1.714500      -2.562900    
 H   0.8206000     -0.3243000     -0.9242000    
 H    4.596700     -0.4463000      0.9162000    
 H    4.375500       1.304200      0.6261000    
 H    5.191000     -0.7469000      -1.498300    
 H    4.987400      0.9701000      -1.772100    
 H    7.047900     -0.2807000      0.1299000    
 H    7.384100      0.4102000      -1.466700    
 H    6.842000       1.460300     -0.1464000    


%chk=000091875-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091875

0 1
O -0.615641 -0.199976 2.079057
O 2.969632 0.162025 -0.235664
O 2.298827 0.155106 2.021386
N 0.778500 -0.148310 0.200185
C -1.652096 -0.615306 -0.147318
C -2.983451 -0.538676 0.655195
C -1.632464 0.375466 -1.362707
C -1.393931 -2.099132 -0.674188
C -3.491009 0.865675 1.078039
C -1.559782 1.883092 -0.996218
C -4.016612 1.737169 -0.091027
C -2.938348 2.576691 -0.829242
C -0.482957 -0.290424 0.835084
C -1.330345 -3.144733 0.467176
C -2.407748 -2.557687 -1.751997
C 2.026398 0.065880 0.810732
C 4.377368 0.384976 0.200863
C 5.240347 0.414343 -1.061185
C 6.728604 0.643292 -0.713405
H -2.858608 -1.141401 1.572041
H -3.779311 -1.018274 0.051438
H -2.539413 0.194138 -1.969126
H -0.785622 0.112002 -2.033499
H -0.394498 -2.085666 -1.162830
H -2.706274 1.398696 1.647203
H -4.321570 0.700360 1.792504
H -0.994580 2.422727 -1.781554
H -0.972456 2.009188 -0.066541
H -4.794224 2.431967 0.283627
H -4.533551 1.072650 -0.814059
H -3.332586 2.857398 -1.826919
H -2.776885 3.526856 -0.282468
H -1.006705 -4.122084 0.064232
H -0.622606 -2.854038 1.263604
H -2.320721 -3.289734 0.935056
H -3.436641 -2.604352 -1.351623
H -2.143039 -3.575178 -2.094832
H -2.411952 -1.900287 -2.638592
H 0.808341 -0.181800 -0.821543
H 4.668226 -0.432841 0.886260
H 4.426118 1.337523 0.760827
H 5.118628 -0.540674 -1.605703
H 4.877860 1.217234 -1.730125
H 7.119883 -0.164297 -0.067005
H 7.344889 0.669721 -1.629194
H 6.874205 1.601895 -0.181343


