%chk=000091379.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091379

0 1
 O   0.5983000      0.9121000       1.851900    
 N  -0.1613000       3.145500     -0.1378000    
 C  -0.5983000      0.6944000     -0.2470000    
 C   -1.182600       2.105800     -1.5200000E-02
 C   -1.662500     -0.3830000     -0.1097000    
 C   0.5736000      0.4444000      0.7144000    
 C    1.735100     -0.3746000      0.2633000    
 C   -2.423800     -0.7147000      -1.212700    
 C   -1.836400     -0.9988000       1.113600    
 C  -0.7419000       4.464100      0.1132000    
 C   0.4557000       3.102300      -1.462900    
 C   -3.399900      -1.703100      -1.087000    
 C   -2.812600      -1.987400       1.239100    
 C    1.521800      -1.367200     -0.6666000    
 C    2.977500     -0.1073000      0.7930000    
 C   -3.594200      -2.339400      0.1388000    
 C    2.608200      -2.133400      -1.088900    
 C    4.064000     -0.8733000      0.3706000    
 C    3.879200      -1.886300     -0.5704000    
 H  -0.2130000      0.6302000      -1.271700    
 H   -2.006500       2.282900     -0.7207000    
 H   -1.622100       2.149900      0.9908000    
 H   -2.280000     -0.2230000      -2.170100    
 H   -1.266400     -0.7414000       1.998500    
 H   -1.180200       4.507700       1.116600    
 H   -1.520200       4.719700     -0.6151000    
 H   3.1900000E-02   5.239100      7.7699997E-02
 H    1.109000       3.971900      -1.606100    
 H  -0.2851000       3.109700      -2.270900    
 H    1.113700       2.237000      -1.584900    
 H   -4.009100      -1.976800      -1.943500    
 H   -2.967700      -2.479900       2.194700    
 H   0.5503000      -1.598000      -1.085000    
 H    3.137600      0.6818000       1.521300    
 H   -4.355200      -3.108100      0.2370000    
 H    2.464600      -2.923900      -1.819800    
 H    5.054100     -0.6802000      0.7731000    
 H    4.725100      -2.482900     -0.8991000    


%chk=000091379-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091379

0 1
O 0.600485 1.015744 1.813467
N -0.232578 3.158656 -0.513306
C -0.558901 0.685839 -0.309007
C -1.170081 2.097343 -0.083449
C -1.610738 -0.415670 -0.122341
C 0.625950 0.484221 0.663751
C 1.786456 -0.376026 0.252864
C -2.170536 -1.068668 -1.250127
C -2.082993 -0.762184 1.170681
C -0.260729 4.361228 0.340289
C -0.321772 3.472049 -1.950079
C -3.178618 -2.046498 -1.094329
C -3.088965 -1.740928 1.328279
C 1.765075 -1.194807 -0.908340
C 2.944151 -0.380255 1.078824
C -3.640903 -2.387276 0.197772
C 2.878854 -1.997369 -1.235981
C 4.059115 -1.173321 0.746130
C 4.029688 -1.985330 -0.414028
H -0.182336 0.639179 -1.347070
H -2.151021 2.156047 -0.613856
H -1.364339 2.211750 0.997207
H -1.820819 -0.803683 -2.256590
H -1.654340 -0.269470 2.051085
H -0.076868 4.068378 1.388212
H -1.227861 4.923590 0.294219
H 0.545424 5.051997 0.031581
H 0.491651 4.164531 -2.232656
H -1.295877 3.944063 -2.240360
H -0.201955 2.552959 -2.552047
H -3.601763 -2.540220 -1.976633
H -3.441020 -2.000900 2.333073
H 0.875555 -1.230101 -1.545094
H 2.939313 0.249581 1.974578
H -4.420430 -3.147294 0.321999
H 2.849937 -2.632957 -2.127818
H 4.949094 -1.163124 1.384947
H 4.895394 -2.605275 -0.673350


