%chk=000099787.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099787

0 1
 O  -3.0099999E-02  -1.500500      0.2000000    
 N   -2.303500      0.2593000      0.3591000    
 C   -3.260300       1.067100       1.115100    
 C   -2.766800      0.3201000      -1.026800    
 C   -4.598800      0.6589000      0.5174000    
 C   -4.274000      0.1647000     -0.8889000    
 C  -0.9356000      0.7333000      0.5090000    
 C   3.8600001E-02 -0.1560000     -0.2732000    
 C    1.466000      0.3240000     -0.1276000    
 C    1.965900       1.242900      -1.034200    
 C    2.241600     -0.1655000      0.9094000    
 C   0.8271000      -2.353400     -0.5427000    
 C    3.281800       1.685800     -0.9001000    
 C    3.557400      0.2776000       1.043600    
 C   0.7134000      -3.761600      1.1000000E-03
 C    4.077400       1.203200      0.1389000    
 H   -3.098400       2.141500      0.9597000    
 H   -3.218600      0.8598000       2.189000    
 H   -2.363100     -0.4829000      -1.650800    
 H   -2.534200       1.285100      -1.495200    
 H   -5.302900       1.496900      0.5002000    
 H   -5.054400     -0.1512000       1.099000    
 H   -4.568900     -0.8865000     -0.9891000    
 H   -4.808500      0.7378000      -1.653300    
 H  -0.8366000       1.779300      0.1891000    
 H  -0.6739000      0.6952000       1.574800    
 H  -0.2125000     -0.1558000      -1.341600    
 H    1.352900       1.626000      -1.844900    
 H    1.855400     -0.8606000       1.649200    
 H   0.5014000      -2.359800      -1.590300    
 H    1.884600      -2.083900     -0.5280000    
 H    3.686400       2.407300      -1.603800    
 H    4.174800     -9.2100002E-02   1.857000    
 H    1.331500      -4.456000     -0.5753000    
 H    1.029000      -3.795300       1.049200    
 H  -0.3256000      -4.105700     -3.0300001E-02
 H    5.101400       1.549500      0.2446000    


%chk=000099787-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099787

0 1
O 0.109797 -1.631709 0.423969
N -2.270423 0.261169 0.127529
C -3.317754 0.508949 1.145447
C -2.732057 0.851532 -1.157703
C -4.615054 0.291047 0.342183
C -4.286929 0.940077 -1.035645
C -0.889565 0.560654 0.514850
C 0.151446 -0.316399 -0.228717
C 1.549497 0.303308 -0.176136
C 2.002664 1.145849 -1.221128
C 2.390697 0.084822 0.943578
C 0.721790 -2.702650 -0.379074
C 3.271328 1.765337 -1.149024
C 3.660113 0.700085 1.017433
C 0.562222 -4.005765 0.403878
C 4.104109 1.544871 -0.027323
H -3.289256 1.552584 1.555088
H -3.205719 -0.192579 1.991462
H -2.416568 0.222480 -2.012132
H -2.295403 1.869838 -1.319826
H -5.498099 0.742824 0.827064
H -4.794106 -0.791998 0.223930
H -4.802279 0.425863 -1.864644
H -4.609743 1.996714 -1.048835
H -0.631338 1.636565 0.339465
H -0.762710 0.361772 1.595345
H -0.161156 -0.417372 -1.293012
H 1.363399 1.313264 -2.098018
H 2.042707 -0.583020 1.739798
H 0.205460 -2.764317 -1.362902
H 1.793861 -2.476704 -0.565832
H 3.611768 2.412375 -1.965721
H 4.303848 0.521167 1.886479
H 0.990377 -4.853084 -0.162582
H 1.078879 -3.939225 1.377363
H -0.505397 -4.211097 0.593572
H 5.089493 2.021274 0.029121


