%chk=000001372.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001372

0 1
 O    3.176800      -3.315000      0.5987000    
 O    3.959600       3.638000      0.7255000    
 O    3.251000       2.416200      -1.053900    
 N  -0.5534000      0.4609000     -0.7740000    
 C   0.2582000     -0.6232000     -0.5263000    
 C  -1.9000000E-03   1.595100     -0.2414000    
 C    1.184400       1.246300      0.3616000    
 C    1.362100     -0.1550000      0.1895000    
 C   -1.808600      0.4075000      -1.495200    
 C    2.107000       2.163600       1.063300    
 C    2.359400      -1.072800      0.5750000    
 C   0.1011000      -1.968700     -0.8774000    
 C  -0.6596000       2.914700     -0.3552000    
 C   -2.965000      0.1523000     -0.5668000    
 C    2.215600      -2.421800      0.2308000    
 C    1.103000      -2.860600     -0.4844000    
 C    3.138200       2.743700      0.1207000    
 C   -3.630000       1.226300      9.2000002E-03
 C   -3.351600      -1.153700     -0.2982000    
 C   -4.701700      0.9898000      0.8703000    
 C   -4.423300      -1.390300      0.5627000    
 C   -5.098300     -0.3185000       1.146900    
 C    2.976900      -4.674800      0.2188000    
 H   -1.740100     -0.3823000      -2.253200    
 H   -1.952300       1.326000      -2.071000    
 H    2.637700       1.635000       1.862900    
 H    1.553800       2.991300       1.520700    
 H    3.232000     -0.7417000       1.131300    
 H  -0.7446000      -2.324700      -1.453100    
 H   -1.365900       3.064000      0.4660000    
 H   8.3099999E-02   3.717300     -0.2812000    
 H   -1.168400       3.074200      -1.307900    
 H   0.9482000      -3.893500     -0.7796000    
 H   -3.360100       2.251200     -0.2188000    
 H   -2.854400      -2.001300     -0.7561000    
 H   -5.232600       1.824400       1.318800    
 H   -4.735500      -2.408800      0.7744000    
 H   -5.934600     -0.5026000       1.815000    
 H    3.834400      -5.243600      0.5931000    
 H    2.968400      -4.792400     -0.8702000    
 H    2.083900      -5.098700      0.6907000    
 H    4.635100       3.990500      0.1075000    


%chk=000001372-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001372

0 1
O 3.445830 -3.306003 0.337829
O 4.318608 2.067133 0.404401
O 2.897515 3.812543 -0.172327
N -0.582312 0.427866 -0.721966
C 0.284998 -0.672593 -0.573629
C -0.036388 1.535392 -0.037917
C 1.178922 1.154830 0.547862
C 1.411398 -0.236338 0.209327
C -1.862982 0.412764 -1.433462
C 2.099129 2.036031 1.365098
C 2.458627 -1.143542 0.494217
C 0.185539 -1.992770 -1.052546
C -0.725574 2.868832 -0.036043
C -3.097864 0.298722 -0.533215
C 2.359343 -2.464491 0.008733
C 1.232817 -2.892749 -0.756647
C 3.098218 2.756932 0.468738
C -4.336134 0.828519 -0.973710
C -3.036159 -0.357010 0.720887
C -5.498297 0.697173 -0.180658
C -4.196864 -0.485605 1.516881
C -5.431823 0.037923 1.068696
C 3.405674 -4.683226 -0.147341
H -1.837427 -0.438881 -2.139390
H -1.945485 1.324361 -2.054914
H 2.650103 1.430685 2.103804
H 1.525815 2.808914 1.905347
H 3.346138 -0.846838 1.060472
H -0.677216 -2.335483 -1.634112
H -1.766255 2.796357 0.332026
H -0.177340 3.579725 0.601782
H -0.757584 3.314279 -1.049609
H 1.166811 -3.921284 -1.122454
H -4.392737 1.348962 -1.938738
H -2.079858 -0.758028 1.074691
H -6.449186 1.113465 -0.531967
H -4.136886 -0.993224 2.486237
H -6.330381 -0.061575 1.687742
H 4.336386 -5.143725 0.216949
H 3.380489 -4.726049 -1.254706
H 2.535554 -5.235211 0.261251
H 4.924838 2.527520 -0.238121


