%chk=000133536.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133536

0 1
 O   -2.361900       2.334800     -0.2230000    
 O   -2.378200      -2.340200     -0.2197000    
 N   -2.373300     -1.7000000E-03 -0.3240000    
 C   9.3599997E-02  9.9999998E-03 -4.8799999E-02
 C    1.443500      1.9999999E-04 -0.7731000    
 C   -1.088000      1.1800000E-02  -1.014300    
 C    2.644200     -6.1200000E-02  0.1768000    
 C    4.025000      1.0500000E-02 -0.4824000    
 C   -5.054900      7.0000002E-03  0.3560000    
 C   -4.247700       1.233900      0.7181000    
 C   -4.254200      -1.224400      0.7174000    
 C    5.180500      9.3000000E-03  0.5203000    
 C   -2.920600       1.257600     -3.1000001E-03
 C   -2.926500      -1.257300     -3.5000001E-03
 C    6.532800     -1.1000000E-02 -0.1936000    
 C    7.685800      2.0900000E-02  0.7969000    
 H   3.8699999E-02  0.8886000      0.6056000    
 H   2.9400000E-02 -0.8673000      0.6070000    
 H    1.486500     -0.8587000      -1.453800    
 H    1.523300      0.9010000      -1.393900    
 H   -1.027100     -0.8667000      -1.667900    
 H   -1.032200      0.8931000      -1.664400    
 H    2.581100     -0.9860000      0.7642000    
 H    2.560800      0.7653000      0.8943000    
 H    4.081800      0.9174000      -1.096900    
 H    4.132200     -0.8413000      -1.165500    
 H   -6.007400      9.3999999E-03  0.8967000    
 H   -5.281900      7.7999998E-03 -0.7173000    
 H   -4.050900       1.273200       1.795300    
 H   -4.807400       2.134200      0.4417000    
 H   -4.819500      -2.121400      0.4413000    
 H   -4.057700      -1.265000       1.794700    
 H    5.098500     -0.8675000       1.173900    
 H    5.109800      0.8973000       1.159900    
 H    6.614100     -0.9121000     -0.8125000    
 H    6.612600      0.8521000     -0.8647000    
 H    8.642500      4.9999999E-03  0.2656000    
 H    7.652200      0.9279000       1.408900    
 H    7.653300     -0.8460000       1.464600    


%chk=000133536-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133536

0 1
O -2.360811 2.334040 -0.273558
O -2.361629 -2.327819 -0.294008
N -2.403735 0.003438 -0.343904
C 0.096990 0.001461 -0.016033
C 1.463683 0.005237 -0.735748
C -1.073425 0.006217 -1.022184
C 2.658854 0.001654 0.243552
C 4.029340 0.001919 -0.470280
C -5.162443 0.000732 0.372249
C -4.328886 1.254845 0.692834
C -4.329539 -1.256705 0.681301
C 5.227996 -0.001100 0.504668
C -2.973412 1.264116 -0.006080
C -2.973868 -1.260039 -0.017182
C 6.598369 -0.001669 -0.210547
C 7.790860 -0.002073 0.770047
H 0.019330 0.892822 0.636041
H 0.019679 -0.896355 0.627145
H 1.533347 -0.881411 -1.399953
H 1.532327 0.897651 -1.392260
H -1.030793 -0.894316 -1.657089
H -1.030307 0.912338 -1.649081
H 2.589259 -0.888152 0.903402
H 2.591133 0.888515 0.907506
H 4.097470 0.891338 -1.131378
H 4.095824 -0.884803 -1.135157
H -6.092732 -0.001701 0.967747
H -5.457780 0.005693 -0.693923
H -4.143689 1.318665 1.784809
H -4.841835 2.187852 0.405453
H -4.842781 -2.186721 0.384896
H -4.144822 -1.331007 1.772689
H 5.161569 -0.889994 1.166780
H 5.163772 0.885831 1.169612
H 6.662145 -0.888886 -0.873408
H 6.662816 0.885460 -0.873473
H 8.758001 -0.004126 0.234320
H 7.767489 0.891452 1.422368
H 7.765034 -0.893898 1.424628


