%chk=000133974.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133974

0 1
 O   -1.109400     -0.5114000      -1.244700    
 O   -2.266900      -1.200900      0.6814000    
 O   0.4141000      -2.621900     -0.5679000    
 O   -3.538400       3.337900       1.251500    
 O    2.741800     -0.4472000       2.003000    
 O   -3.611500     -0.6874000      -1.125500    
 O   0.7624000      -4.812000      5.0500002E-02
 O    4.339300       2.569300      -2.884900    
 O    2.054400       1.578000       2.954700    
 N   -2.806700       1.642900     -0.1767000    
 N  -0.2259000      0.4893000      -1.700900    
 N   0.6731000      -4.206800      -2.166100    
 C   -1.664400       1.102800      0.5050000    
 C   -1.516600       2.158800     -0.5342000    
 C   -1.252000     -0.3240000      0.1824000    
 C  -0.9301000       1.766100      -1.860600    
 C   0.1048000     -0.7197000      0.8410000    
 C    1.262800     -1.1100000E-02  0.1526000    
 C    1.057900      0.5736000      -1.114600    
 C   -3.757600       2.413800      0.4723000    
 C   0.3480000      -2.237500      0.7885000    
 C    2.517600      8.5600004E-02  0.7683000    
 C    2.114100       1.248600      -1.740100    
 C   -5.157200       1.980100      0.1310000    
 C   -3.395700      -1.283400     -7.8900002E-02
 C    3.562100      0.7545000      0.1315000    
 C    3.360900       1.334300      -1.119900    
 C   -4.363200      -2.231900      0.5616000    
 C   0.6283000      -3.955400     -0.8170000    
 C    4.452900       2.033300      -1.779200    
 C    2.462000      0.4292000       3.063100    
 C    2.739200     -0.2473000       4.372900    
 H   -1.597300       1.361100       1.553200    
 H   -1.322300       3.181800     -0.2458000    
 H  -0.2698000       2.555800      -2.236100    
 H   -1.727500       1.647100      -2.604400    
 H   6.1700001E-02 -0.4234000       1.896500    
 H  -0.4609000      -2.778000       1.293800    
 H    1.287200      -2.502100       1.288100    
 H    1.953400       1.697100      -2.718000    
 H   -5.845200       2.816700      0.2814000    
 H   -5.222100       1.662700     -0.9136000    
 H   -5.446700       1.150700      0.7817000    
 H    4.531200      0.8237000      0.6205000    
 H   -4.643800      -1.862000       1.551000    
 H   -5.264900      -2.300000     -5.3599998E-02
 H   -3.914800      -3.226000      0.6339000    
 H    5.415000       2.069300      -1.240500    
 H   0.5566000      -3.462900      -2.845900    
 H   0.8242000      -5.143700      -2.524300    
 H    2.105900      -1.132500       4.471300    
 H    2.509000      0.4397000       5.192100    
 H    3.795500     -0.5203000       4.430900    


%chk=000133974-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133974

0 1
O -1.002386 -0.589840 -1.355382
O -2.217277 -1.238036 0.581211
O 0.778582 -2.729648 -0.432152
O -4.018079 3.693850 -0.489066
O 2.668733 -0.204691 2.189736
O -3.879744 -0.954548 -1.094483
O -1.184488 -4.045650 -0.563663
O 4.630051 2.415087 -2.946412
O 1.254737 1.442797 3.084956
N -2.699823 1.784699 -0.384205
N -0.063430 0.395303 -1.938781
N 0.285655 -3.790322 -2.372701
C -1.582013 1.166990 0.341500
C -1.361779 2.203488 -0.802056
C -1.216725 -0.302855 0.108211
C -0.830103 1.670635 -2.139883
C 0.102077 -0.677435 0.834174
C 1.256901 0.060413 0.173255
C 1.153628 0.525614 -1.173257
C -3.803680 2.554803 0.012065
C 0.377489 -2.207047 0.884954
C 2.484659 0.271111 0.843189
C 2.250702 1.149479 -1.805247
C -4.750760 1.849329 0.970390
C -3.429966 -1.575497 -0.124388
C 3.584206 0.893467 0.237155
C 3.463830 1.336336 -1.104609
C -3.999924 -2.808212 0.533094
C -0.151080 -3.564385 -1.092517
C 4.627964 1.983946 -1.763823
C 2.045817 0.497578 3.262120
C 2.497837 -0.088727 4.576695
H -1.380358 1.519611 1.363569
H -1.044332 3.209122 -0.498147
H -0.150485 2.398326 -2.612483
H -1.659342 1.448809 -2.828143
H 0.003830 -0.355384 1.887556
H -0.514766 -2.749294 1.238952
H 1.238205 -2.390560 1.548875
H 2.186116 1.476855 -2.848183
H -5.428089 2.588386 1.423493
H -5.349865 1.114058 0.402611
H -4.208591 1.299497 1.759972
H 4.516222 1.023664 0.797166
H -4.020641 -2.696374 1.630081
H -5.011274 -3.002113 0.147278
H -3.331582 -3.655512 0.293730
H 5.539972 2.070672 -1.120395
H 1.081016 -3.272109 -2.738533
H -0.278897 -4.372114 -2.984999
H 2.330053 -1.179291 4.589435
H 1.953387 0.387220 5.404339
H 3.582313 0.073497 4.706046


