%chk=000088632.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088632

0 1
 O   -3.976700      -1.074600      0.4999000    
 O   -3.964800       1.120100      0.4550000    
 N   -3.378600      1.6700000E-02  0.3393000    
 C    3.046700     -1.9500000E-02  0.3057000    
 C    2.174200     -3.9999999E-02 -0.9512000    
 C    4.532700      1.9000000E-03 -5.1800001E-02
 C   0.7059000     -2.5200000E-02 -0.6108000    
 C   3.5599999E-02  -1.226000     -0.4320000    
 C   4.8799999E-02   1.189400     -0.4813000    
 C    5.404600      6.3400000E-02   1.192100    
 C   -1.323000      -1.212100     -0.1164000    
 C   -1.309800       1.203400     -0.1656000    
 C   -1.995800      2.6000000E-03  1.7000001E-02
 H    2.830000     -0.8981000      0.9264000    
 H    2.804300      0.8625000      0.9124000    
 H    2.403400     -0.9278000      -1.554700    
 H    2.410100      0.8218000      -1.588900    
 H    4.789400     -0.8941000     -0.6289000    
 H    4.751400      0.8698000     -0.6850000    
 H   0.5517000      -2.176800     -0.5316000    
 H   0.5752000       2.129500     -0.6195000    
 H    5.233000     -0.8062000       1.834600    
 H    5.195800      0.9670000       1.773500    
 H    6.462900      7.6099999E-02  0.9130000    
 H   -1.824700      -2.166900      1.9300001E-02
 H   -1.800900       2.168400     -6.9100000E-02


%chk=000088632-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088632

0 1
O -4.041687 -1.131051 0.570118
O -4.044891 1.149277 0.505941
N -3.453291 0.005733 0.388209
C 3.080137 0.008242 0.283575
C 2.197977 -0.025017 -0.998364
C 4.591993 0.003709 -0.036066
C 0.715377 -0.018503 -0.674417
C 0.011858 -1.235132 -0.461364
C 0.008836 1.206260 -0.528890
C 5.466513 0.037288 1.235551
C -1.351550 -1.240060 -0.112380
C -1.354683 1.227326 -0.181045
C -2.018335 -0.002460 0.024538
H 2.831413 -0.864133 0.920761
H 2.827879 0.909883 0.877205
H 2.456817 -0.929793 -1.581800
H 2.454745 0.850103 -1.626145
H 4.836914 -0.898442 -0.632895
H 4.832997 0.876095 -0.677085
H 0.540994 -2.188239 -0.575876
H 0.535911 2.152702 -0.696027
H 5.264053 -0.838958 1.879367
H 5.264158 0.946130 1.832607
H 6.542719 0.030771 0.984328
H -1.904967 -2.168452 0.051290
H -1.910486 2.162022 -0.069734


