%chk=000041568.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041568

0 1
 O   0.1589000     -4.0199999E-02  0.1470000    
 O    2.684600       1.012100     -0.2916000    
 N   -4.598700      0.9369000      0.2205000    
 C    1.214400     -0.8838000     -0.2934000    
 C   -1.103700     -0.4984000     -0.3182000    
 C   -2.185700      0.4477000      0.1882000    
 C    2.530300     -0.3092000      0.2156000    
 C   0.9769000      -2.288300      0.2405000    
 C   -3.584900      3.0200001E-02 -0.2447000    
 C    3.908100       1.593000      0.1361000    
 H    1.232600     -0.8853000      -1.390500    
 H   -1.341100      -1.492100      7.1699999E-02
 H   -1.109700     -0.5275000      -1.414000    
 H   -1.966500       1.462600     -0.1690000    
 H   -2.128900      0.5025000       1.283400    
 H    2.521900     -0.2634000       1.311500    
 H    3.370700     -0.9318000     -0.1124000    
 H   0.2104000      -2.819600     -0.3330000    
 H    1.887100      -2.892800      0.1598000    
 H   0.6645000      -2.275400       1.290500    
 H   -3.628300     -2.0500001E-02  -1.338400    
 H   -3.800300     -0.9765000      0.1313000    
 H   -4.589900      0.9806000       1.238600    
 H   -5.520400      0.5914000     -4.3200001E-02
 H    4.758800       1.010100     -0.2302000    
 H    3.940000       1.661600       1.227800    
 H    3.973400       2.602500     -0.2784000    


%chk=000041568-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041568

0 1
O 0.094076 -0.387659 0.447517
O 2.687933 0.779051 -0.589896
N -4.579330 1.062414 0.365650
C 1.248568 -1.111134 -0.125806
C -1.129578 -0.486311 -0.356172
C -2.212987 0.326681 0.360206
C 2.497812 -0.351231 0.322038
C 1.253821 -2.578425 0.347682
C -3.570837 0.272704 -0.369839
C 3.705082 1.711105 -0.114515
H 1.201746 -1.064387 -1.235441
H -1.447623 -1.549365 -0.461309
H -0.941328 -0.080864 -1.375654
H -1.890115 1.378967 0.447624
H -2.323769 -0.067679 1.390480
H 2.347203 0.002298 1.365467
H 3.391226 -1.015461 0.294155
H 0.296517 -3.070688 0.100152
H 2.066583 -3.150018 -0.138317
H 1.390626 -2.632390 1.442921
H -3.460120 0.716519 -1.378648
H -3.857146 -0.799461 -0.519985
H -4.718659 0.752491 1.333026
H -5.468191 1.183562 -0.129037
H 4.701059 1.224596 -0.022097
H 3.429103 2.145509 0.870132
H 3.762828 2.515577 -0.864833


