%chk=000060128.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060128

0 1
 O   0.9380000      -2.125300     -0.2195000    
 O   -6.743200       1.171900     -0.4104000    
 O   -4.909400      0.6933000      -1.663000    
 O    6.582600      0.5913000     -0.4538000    
 N   -1.774900      -1.605400      0.1411000    
 C   -2.244400      0.5487000      0.4825000    
 C   -1.206500     -0.3562000      0.2492000    
 C   -3.453500     -0.2010000      0.5105000    
 C   -3.132500      -1.521700      0.2976000    
 C   0.1332000      3.7900001E-02  0.1593000    
 C   -4.811800      0.3398000      0.7288000    
 C   -1.932100       1.914300      0.6337000    
 C   0.4187000       1.397600      0.3125000    
 C   -3.981900      -2.726300      0.2244000    
 C  -0.5965000       2.323100      0.5460000    
 C    1.197500     -0.9191000     -8.3899997E-02
 C    2.634000     -0.5150000     -0.1830000    
 C   -5.471000      0.7306000     -0.5755000    
 C    3.391200     -0.4988000      0.9644000    
 C    3.138000     -0.1773000      -1.416700    
 C    4.731200     -0.1227000      0.8726000    
 C    4.478200      0.1987000      -1.508400    
 C    5.274700      0.2261000     -0.3638000    
 C    7.340400      0.5956000      0.7552000    
 H   -1.261600      -2.459400     -2.9100001E-02
 H   -4.774400       1.226200       1.371500    
 H   -5.445000     -0.4071000       1.221000    
 H   -2.710800       2.649500      0.8149000    
 H    1.434900       1.778500      0.2551000    
 H   -4.386700      -2.967700       1.212500    
 H   -4.821600      -2.565700     -0.4595000    
 H   -3.424400      -3.598000     -0.1339000    
 H  -0.3504000       3.375400      0.6615000    
 H    2.970700     -0.7703000       1.928000    
 H    2.521100     -0.1978000      -2.309800    
 H    5.292700     -0.1235000       1.800600    
 H    4.896000      0.4689000      -2.474400    
 H   -7.150700       1.440400      -1.261300    
 H    6.951000       1.327200       1.471500    
 H    8.357200      0.9100000      0.4982000    
 H    7.415500     -0.4083000       1.186600    


%chk=000060128-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060128

0 1
O 0.926401 -1.874767 0.969766
O -5.334624 1.650721 -1.532302
O -5.981807 -0.563812 -1.811533
O 6.572170 0.718494 -0.643121
N -1.752232 -1.520221 0.618266
C -2.475632 0.632150 0.433592
C -1.311878 -0.207559 0.536800
C -3.633328 -0.245318 0.458863
C -3.156127 -1.559882 0.567914
C 0.019122 0.300860 0.538766
C -5.081466 0.186678 0.376093
C -2.300979 2.035240 0.357437
C 0.145632 1.718466 0.501717
C -3.891941 -2.866573 0.624156
C -0.990242 2.563285 0.411836
C 1.154717 -0.653715 0.629139
C 2.559028 -0.242822 0.319863
C -5.526576 0.336316 -1.073613
C 3.614996 -0.914694 0.989490
C 2.893563 0.715410 -0.681080
C 4.964018 -0.622155 0.714730
C 4.234318 1.003952 -0.981072
C 5.275523 0.346645 -0.275988
C 7.692996 0.054654 0.031924
H -1.088783 -2.285327 0.777600
H -5.224235 1.149435 0.895360
H -5.740879 -0.563184 0.844279
H -3.165527 2.700757 0.259483
H 1.139295 2.169515 0.577128
H -3.630068 -3.444792 1.530701
H -4.981023 -2.702220 0.622738
H -3.657978 -3.498213 -0.253688
H -0.843821 3.648471 0.385331
H 3.354482 -1.677152 1.730889
H 2.101340 1.201832 -1.258168
H 5.753377 -1.145877 1.261736
H 4.502741 1.722378 -1.761224
H -5.576437 1.700455 -2.497312
H 7.679384 0.252997 1.120867
H 8.595941 0.495139 -0.414779
H 7.680041 -1.037170 -0.149386


