%chk=000090757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090757

0 1
 O   7.8900002E-02  0.9178000     -5.0099999E-02
 O    1.260000     -0.9375000     -0.7332000    
 O    3.631700       2.988300      0.3669000    
 N   -3.693400     -0.4089000      0.5442000    
 C   -3.658200      0.6535000     -0.4788000    
 C   -2.854900      -1.464500     -5.4900002E-02
 C   -3.809600     -9.1100000E-02  -1.809800    
 C   -3.275500      -1.497900      -1.528400    
 C   -2.279300       1.330600     -0.3522000    
 C   -1.393400      -1.005300      0.1152000    
 C   -1.119700      0.3465000     -0.5608000    
 C   -5.049500     -0.8638000      0.8409000    
 C   -5.877000      0.2274000       1.447400    
 C    1.213900      0.1644000     -0.2015000    
 C    2.408700      0.9017000      0.3966000    
 C   -6.997700      0.7094000      0.8981000    
 C    2.580300       2.272200     -0.2740000    
 C    3.669500      5.5799998E-02  0.3138000    
 C    3.975200     -0.7923000       1.359500    
 C    4.471900      0.1596000     -0.8049000    
 C    5.131600      -1.568500       1.283500    
 C    5.628300     -0.6167000     -0.8808000    
 C    5.958100      -1.480800      0.1635000    
 H   -4.422400       1.427900     -0.3605000    
 H   -2.982600      -2.437500      0.4328000    
 H   -3.270100      0.3930000      -2.630400    
 H   -4.865000     -0.1533000      -2.100400    
 H   -4.075400      -2.230800      -1.686700    
 H   -2.451100      -1.762200      -2.198600    
 H   -2.189400       1.803700      0.6353000    
 H   -2.190300       2.148600      -1.078200    
 H   -1.146900     -0.9459000       1.184200    
 H  -0.7622000      -1.797900     -0.2972000    
 H  -0.9886000      0.1976000      -1.640800    
 H   -5.555500      -1.283100     -3.7300002E-02
 H   -4.996800      -1.674400       1.578800    
 H   -5.543400      0.6432000       2.395000    
 H    2.192900       1.067500       1.461400    
 H   -7.376100      0.3298000     -4.4500001E-02
 H   -7.554300       1.499700       1.389700    
 H    2.766500       2.220600      -1.351000    
 H    1.669100       2.868300     -0.1478000    
 H    3.336200     -0.8695000       2.234100    
 H    4.240100      0.7951000      -1.651000    
 H    3.695100       3.853900     -7.1599998E-02
 H    5.387800      -2.242100       2.095900    
 H    6.268900     -0.5539000      -1.755700    
 H    6.857500      -2.086700      0.1035000    


%chk=000090757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090757

0 1
O 0.201497 1.150779 -0.111231
O 1.240132 0.753234 -2.164789
O 4.511790 2.935867 -0.323401
N -3.463593 -0.730220 0.368895
C -3.580136 0.684272 -0.117084
C -2.646389 -1.353394 -0.723569
C -3.905294 0.560107 -1.652864
C -3.283296 -0.820403 -2.060277
C -2.214761 1.374594 0.136236
C -1.183760 -0.872801 -0.539972
C -1.111285 0.663544 -0.664021
C -4.771539 -1.404227 0.606674
C -5.455720 -0.845807 1.837258
C 1.300525 1.105643 -0.959688
C 2.572849 1.521385 -0.225380
C -6.751004 -0.446420 1.889837
C 3.472296 2.344033 -1.174810
C 3.295641 0.285965 0.329432
C 3.716138 0.256820 1.680411
C 3.579264 -0.825566 -0.505294
C 4.409519 -0.862649 2.193029
C 4.270979 -1.945572 0.006507
C 4.688514 -1.968745 1.357731
H -4.372117 1.209183 0.442696
H -2.684744 -2.454067 -0.645128
H -3.480174 1.400891 -2.229691
H -4.996953 0.569232 -1.819446
H -4.063766 -1.514859 -2.419176
H -2.532347 -0.726529 -2.864755
H -1.983045 1.309646 1.213899
H -2.259015 2.443199 -0.145402
H -0.843199 -1.168909 0.468435
H -0.520577 -1.342859 -1.288639
H -1.134736 0.956098 -1.730323
H -5.473429 -1.354952 -0.261428
H -4.545671 -2.476808 0.777688
H -4.817907 -0.782962 2.730934
H 2.283881 2.174251 0.616373
H -7.401222 -0.486552 1.006341
H -7.200564 -0.073971 2.817105
H 3.900197 1.683863 -1.955129
H 2.870870 3.135028 -1.670635
H 3.512201 1.118441 2.325997
H 3.250331 -0.816582 -1.551772
H 5.203134 3.358628 -0.890480
H 4.733368 -0.870067 3.239976
H 4.482089 -2.800205 -0.646556
H 5.224931 -2.838078 1.754687


