%chk=000146824.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146824

0 1
 O   -3.850500      0.4149000     -0.4832000    
 O    5.603100     -0.3422000      0.3550000    
 O   -2.287700       1.287700      0.9743000    
 O    4.010700      -1.340000       1.633600    
 O   -4.225500       1.964100       2.705300    
 N  -7.7000000E-02  0.6521000     -0.9127000    
 N    1.614400      -1.133400      0.3269000    
 C   -1.863100     -0.9011000     -0.7180000    
 C   -2.805700      4.8099998E-02  -1.389000    
 C  -0.5316000     -0.5458000     -0.5122000    
 C   0.3274000      -1.452600      0.1173000    
 C   -2.353400      -2.140000     -0.3094000    
 C    2.068800      6.4499997E-02 -7.3600002E-02
 C    1.210000      0.9713000     -0.7031000    
 C   -3.433400     -0.5429000      -2.652700    
 C  -0.1691000      -2.689500      0.5235000    
 C   -1.501800      -3.039100      0.3147000    
 C    3.400400      0.4199000      0.1321000    
 C    1.706400       2.208300      -1.109200    
 C    3.890800       1.658800     -0.2764000    
 C    3.039200       2.557800     -0.9004000    
 C   -3.443500       1.031100      0.6657000    
 C    4.323300     -0.5014000      0.7857000    
 C   -4.652200       1.349500       1.505900    
 H   -2.309100      0.9746000      -1.701700    
 H   -3.393500      -2.416000     -0.4565000    
 H   -4.092400      -1.388800      -2.429400    
 H   -2.669200     -0.8719000      -3.364300    
 H   -4.062900      0.2088000      -3.142300    
 H   0.4896000      -3.402800       1.015000    
 H   -1.869800      -4.006800      0.6414000    
 H    1.047200       2.922200      -1.598900    
 H    4.922600       1.955200     -0.1095000    
 H    3.405200       3.528300      -1.221400    
 H   -5.174900      0.4238000       1.759800    
 H   -5.318100       2.031200      0.9703000    
 H    6.218000     -0.9649000      0.7983000    
 H   -3.840700       2.826400       2.472500    


%chk=000146824-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146824

0 1
O -4.102834 0.296254 -0.393099
O 6.022564 -0.635111 -0.029404
O -3.540865 1.753918 1.353562
O 4.504657 -1.406014 1.549332
O -6.064459 1.604099 2.425135
N 0.112912 0.714892 -0.899080
N 1.856653 -1.233858 0.323369
C -1.816370 -0.647800 -0.328186
C -2.713792 0.401141 -0.970015
C -0.389460 -0.421363 -0.323123
C 0.499842 -1.415869 0.277833
C -2.310253 -1.828542 0.222615
C 2.354991 -0.077238 -0.208852
C 1.469883 0.898179 -0.853090
C -2.876486 0.214933 -2.483672
C -0.057785 -2.617086 0.831367
C -1.434240 -2.812284 0.800687
C 3.781072 0.189830 -0.189604
C 2.023672 2.070203 -1.469739
C 4.273118 1.333721 -0.828511
C 3.399100 2.274790 -1.465109
C -4.362739 1.016003 0.758110
C 4.729628 -0.702063 0.543434
C -5.798828 0.819039 1.235667
H -2.322025 1.406640 -0.739526
H -3.390673 -2.006142 0.221659
H -3.300622 -0.776552 -2.717462
H -1.887652 0.302385 -2.965034
H -3.539526 0.994001 -2.896865
H 0.631974 -3.342562 1.271921
H -1.867760 -3.723746 1.225651
H 1.328333 2.776021 -1.934178
H 5.351919 1.511616 -0.825023
H 3.827354 3.163445 -1.939468
H -5.959688 -0.257816 1.442890
H -6.490261 1.114572 0.423070
H 6.630794 -1.205356 0.514063
H -5.220149 2.073120 2.672076


