%chk=000043325.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043325

0 1
 O   -1.340500      0.8617000     -0.1337000    
 O  -1.9500000E-02 -0.7645000      0.7833000    
 O    6.377800      0.3850000      0.2337000    
 N   -4.953900      0.1795000      0.1773000    
 N   0.8853000       1.129100     -0.2540000    
 C   -6.068100       1.128700      0.2865000    
 C   -5.190400     -0.9155000     -0.7734000    
 C   -7.398100      0.5353000      0.7616000    
 C   -6.116400      -1.985700     -0.1964000    
 C   -8.092600     -0.3032000     -0.3038000    
 C   -7.608800      -1.744400     -0.3955000    
 C   -3.731400      0.9042000     -0.1879000    
 C   -2.497900      0.1334000      0.2545000    
 C  -0.1279000      0.3026000      0.1915000    
 C    2.280600      0.9394000     -0.1314000    
 C    3.161700       1.889900     -0.6472000    
 C    2.776500     -0.1976000      0.5064000    
 C    5.034400      0.5661000      0.1127000    
 C    6.852000     -0.9604000      0.2603000    
 C    8.259400     -0.9972000     -0.3152000    
 C    4.538700       1.703300     -0.5251000    
 C    4.153300     -0.3843000      0.6285000    
 C    8.825900      -2.405600     -0.3328000    
 H   -6.219500       1.657900     -0.6640000    
 H   -5.796400       1.892600       1.027400    
 H   -4.253700      -1.434700      -1.000300    
 H   -5.562600     -0.5430000      -1.736500    
 H   -7.266000     -3.3599999E-02   1.689600    
 H   -8.059400       1.376000       1.008700    
 H   -5.871300      -2.951600     -0.6576000    
 H   -5.906500      -2.117800      0.8735000    
 H   -9.169400     -0.3240000     -9.3500003E-02
 H   -7.990900      0.1819000      -1.282700    
 H   -7.906000      -2.138400      -1.375900    
 H   -8.150600      -2.351500      0.3412000    
 H   -3.688700       1.881200      0.3134000    
 H   -3.691800       1.128300      -1.262400    
 H   -2.501300      1.7100001E-02   1.345500    
 H   -2.444800     -0.8591000     -0.2026000    
 H   0.5952000       1.980100     -0.7295000    
 H    2.788500       2.780500      -1.146200    
 H    2.155500     -0.9716000      0.9358000    
 H    6.859100      -1.316100       1.297100    
 H    6.221600      -1.621400     -0.3487000    
 H    8.252500     -0.5868000      -1.332100    
 H    8.913300     -0.3397000      0.2702000    
 H    5.220300       2.447200     -0.9285000    
 H    4.498200      -1.268400       1.156600    
 H    8.874500      -2.821500      0.6786000    
 H    8.210100      -3.069100     -0.9483000    
 H    9.838800      -2.401700     -0.7473000    


%chk=000043325-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043325

0 1
O -1.390345 0.894762 0.024360
O -0.097933 -1.009378 0.551245
O 6.455215 0.247055 -0.373661
N -5.080466 0.260356 0.126479
N 0.851449 1.038990 -0.180059
C -6.195866 1.219026 0.326192
C -5.376436 -0.846441 -0.828148
C -7.515654 0.595007 0.835626
C -6.277832 -1.945894 -0.217965
C -8.273325 -0.243845 -0.224383
C -7.809606 -1.719288 -0.347045
C -3.799331 0.945869 -0.179377
C -2.621803 0.153238 0.404281
C -0.178823 0.185956 0.170264
C 2.248159 0.758939 -0.201533
C 3.121433 1.805425 -0.607322
C 2.794125 -0.497191 0.159277
C 5.055866 0.345194 -0.292564
C 7.074586 -1.040984 -0.013953
C 8.586369 -0.877834 -0.189840
C 4.509834 1.602404 -0.652777
C 4.191219 -0.700515 0.112980
C 9.344764 -2.177702 0.157185
H -6.427435 1.780456 -0.618963
H -5.850083 1.965996 1.066773
H -4.408989 -1.304402 -1.103919
H -5.822205 -0.456251 -1.778775
H -7.312907 -0.007728 1.742013
H -8.163216 1.437803 1.150371
H -6.030361 -2.917347 -0.690375
H -5.991069 -2.031141 0.846805
H -9.358272 -0.237049 -0.000076
H -8.164488 0.264552 -1.204720
H -8.162642 -2.115822 -1.320221
H -8.312565 -2.326241 0.432129
H -3.809296 1.948899 0.284197
H -3.636277 1.098090 -1.272926
H -2.689440 0.100338 1.504899
H -2.559410 -0.875227 0.007093
H 0.557225 1.977275 -0.458586
H 2.711433 2.783593 -0.889087
H 2.127585 -1.303398 0.472737
H 6.822975 -1.296651 1.037240
H 6.682634 -1.842186 -0.676011
H 8.792930 -0.580590 -1.234875
H 8.932517 -0.048104 0.454210
H 5.188380 2.402232 -0.963700
H 4.585643 -1.680482 0.396904
H 9.165311 -2.481893 1.205579
H 9.032142 -3.014003 -0.496056
H 10.433084 -2.041265 0.029476


