%chk=000065909.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065909

0 1
 O   -2.785000     -0.6267000      -1.801400    
 O    2.032300      0.5076000       2.324600    
 N  -0.8852000      -1.882200     -0.1773000    
 N    3.016600     -0.3151000      0.3224000    
 N   -3.273300      0.3769000      0.9506000    
 N    4.288300      0.9115000       1.741600    
 C    1.908400      -1.018000     -0.2745000    
 C   0.7486000     -6.6900000E-02 -0.5710000    
 C    1.438000      -2.158900      0.6274000    
 C  -0.4670000     -0.8246000      -1.107900    
 C   0.1991000      -2.847200      5.1899999E-02
 C   -2.078300      -2.563400     -0.6798000    
 C   -3.242200      -1.567500     -0.8316000    
 C   -3.536200     -0.9334000      0.5202000    
 C   -4.462300      -2.320500      -1.389800    
 C    4.301300     -0.2094000     -0.2266000    
 C    2.979300      0.3807000       1.561000    
 C   -3.596400      0.5154000      -1.989600    
 C   -4.058100      -1.623500       1.611400    
 C    5.077300      0.5457000      0.6508000    
 C   -2.810900       1.513400      0.2076000    
 C   -2.965800       1.604000      -1.185000    
 C   -3.584100      0.4331000       2.304500    
 C   -4.081900     -0.7730000       2.723100    
 C    4.822300     -0.7111000      -1.400900    
 C    6.400700      0.8363000      0.4035000    
 C   -2.219300       2.591000      0.8948000    
 C   -2.534500       2.764800      -1.855000    
 C    6.164900     -0.4291000      -1.674600    
 C    6.945400      0.3361000     -0.7823000    
 C   -1.791000       3.732500      0.2135000    
 C   -1.951000       3.821300      -1.161800    
 H    2.229500      -1.456700      -1.226000    
 H    1.067700      0.6889000      -1.300600    
 H   0.4563000      0.4835000      0.3324000    
 H    1.199300      -1.795300       1.634200    
 H    2.242500      -2.894800      0.7490000    
 H   -1.105500      3.2499999E-02  -1.162500    
 H  -0.2569000      -1.211500      -2.112700    
 H   0.4653000      -3.364600     -0.8793000    
 H  -0.1282000      -3.611800      0.7670000    
 H   -1.859500      -3.034700      -1.648700    
 H   -2.362000      -3.367100      1.2500000E-02
 H   -4.273500      -2.657800      -2.415600    
 H   -4.716900      -3.197100     -0.7840000    
 H   -5.352900      -1.684000      -1.426900    
 H   -4.646400      0.3746000      -1.712800    
 H   -3.574800      0.7526000      -3.058600    
 H   -4.359900      -2.662200       1.599900    
 H    4.607100       1.464700       2.527500    
 H   -3.478400       1.344400       2.876300    
 H   -4.420500      -1.005100       3.722700    
 H    4.240000      -1.300000      -2.098300    
 H    6.998600       1.423900       1.089800    
 H   -2.043400       2.568400       1.966400    
 H   -2.652500       2.851900      -2.932800    
 H    6.616800     -0.8046000      -2.589200    
 H    7.985900      0.5381000      -1.023300    
 H   -1.329300       4.549000      0.7613000    
 H   -1.620900       4.707600      -1.694800    


%chk=000065909-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065909

0 1
O -3.458605 -0.503468 -1.978697
O 1.699361 1.516576 1.639304
N -0.955461 -1.626771 -0.704586
N 2.935893 0.040141 0.179703
N -3.137524 0.036493 1.061910
N 4.068238 1.619588 1.309631
C 1.832468 -0.800512 -0.345398
C 0.864747 -0.007222 -1.256406
C 1.042104 -1.501870 0.784605
C -0.230120 -0.946789 -1.802694
C -0.051797 -2.402260 0.174464
C -2.151832 -2.365031 -1.145455
C -3.504519 -1.599785 -0.960397
C -3.688539 -1.131704 0.474553
C -4.667084 -2.532879 -1.378645
C 4.298477 -0.079913 -0.173014
C 2.765367 1.102088 1.104299
C -4.065940 0.782836 -1.575946
C -4.247452 -1.886897 1.519856
C 5.019911 0.922868 0.548121
C -2.551710 1.177662 0.417194
C -3.041142 1.617729 -0.843787
C -3.366741 -0.002422 2.448353
C -4.044772 -1.181351 2.754261
C 4.967769 -0.959405 -1.043734
C 6.411107 1.065956 0.418420
C -1.524355 1.895818 1.071782
C -2.499669 2.791803 -1.414258
C 6.371782 -0.816763 -1.176329
C 7.082601 0.177219 -0.458427
C -1.001544 3.070254 0.491463
C -1.494786 3.531418 -0.750135
H 2.318880 -1.586247 -0.958778
H 1.420354 0.443819 -2.100614
H 0.398120 0.805080 -0.674096
H 0.576024 -0.738076 1.429300
H 1.725359 -2.113192 1.404558
H -0.963332 -0.371322 -2.391145
H 0.244616 -1.698423 -2.492503
H 0.441253 -3.246397 -0.382300
H -0.651083 -2.849052 0.988225
H -2.086094 -2.644029 -2.222007
H -2.237641 -3.305023 -0.567868
H -4.520111 -2.836055 -2.429665
H -4.717856 -3.442987 -0.755078
H -5.632118 -2.003737 -1.299621
H -4.967514 0.600810 -0.955665
H -4.370772 1.266746 -2.518794
H -4.743392 -2.849257 1.405478
H 4.236772 2.397243 1.943156
H -3.089002 0.838756 3.078685
H -4.377986 -1.485604 3.745059
H 4.432669 -1.730684 -1.606068
H 6.961254 1.834091 0.971701
H -1.090047 1.516656 2.000650
H -2.872086 3.125186 -2.390788
H 6.915104 -1.489421 -1.848357
H 8.167276 0.262340 -0.581980
H -0.180348 3.587568 0.996465
H -1.087029 4.440407 -1.205264


