%chk=000056480.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056480

0 1
 O  -0.2613000     -4.3000001E-03 -0.1035000    
 O   0.5555000      -1.327800      -1.800600    
 N   -3.931600      0.3324000     -6.2600002E-02
 C   -2.546600      0.5223000      0.3673000    
 C   -4.841300       1.091900      0.7943000    
 C   -4.281300      -1.087500     -4.7600001E-02
 C   -1.592900     -0.2304000     -0.5468000    
 C   -4.499600       2.567600      0.7959000    
 C   -5.692800      -1.316500     -0.5472000    
 C    2.058100     -0.3017000     -0.2597000    
 C    2.606600      -1.112100      0.7143000    
 C   0.7205000     -0.6146000     -0.8231000    
 C    2.716900      0.8129000     -0.7417000    
 C    3.974600       1.129200     -0.2283000    
 C    3.864300     -0.7958000       1.227700    
 C    4.548300      0.3249000      0.7566000    
 C    1.896100      -2.318100       1.236700    
 C    4.706500       2.327300     -0.7316000    
 H   -2.393100      0.2059000       1.407800    
 H   -2.243600       1.573900      0.3167000    
 H   -5.867200       1.026100      0.4174000    
 H   -4.843500      0.7140000       1.824600    
 H   -3.658100      -1.657000     -0.7418000    
 H   -4.160900      -1.530900      0.9487000    
 H   -1.697600      0.1154000      -1.582500    
 H   -1.744900      -1.311900     -0.5055000    
 H   -3.613700       2.793300       1.397700    
 H   -4.350500       2.953500     -0.2184000    
 H   -5.326200       3.134600       1.239600    
 H   -6.449900      -1.022700      0.1864000    
 H   -5.883600     -0.7856000      -1.486300    
 H   -5.846900      -2.384400     -0.7406000    
 H    2.265900       1.435200      -1.510200    
 H    4.326200      -1.411500       1.994900    
 H    5.528400      0.5599000       1.163200    
 H   0.9496000      -2.031500       1.706900    
 H    1.697500      -3.027300      0.4264000    
 H    2.488900      -2.845500       1.992100    
 H    4.010300       3.117300      -1.032900    
 H    5.354100       2.750100      4.4000000E-02
 H    5.323500       2.055600      -1.593800    


%chk=000056480-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000056480

0 1
O -0.269624 -0.045471 0.021058
O 0.294953 -2.169136 -0.732102
N -3.973611 0.494897 0.128380
C -2.529414 0.774448 0.320051
C -4.781715 1.709070 -0.159554
C -4.546556 -0.349816 1.212464
C -1.694861 -0.370876 -0.266306
C -4.576939 2.240932 -1.590773
C -5.753258 -1.187051 0.747703
C 2.061052 -0.635167 0.028374
C 3.155375 -1.538137 -0.168645
C 0.660746 -1.056487 -0.271785
C 2.299315 0.683105 0.512113
C 3.596295 1.148015 0.811769
C 4.454793 -1.056854 0.139304
C 4.677954 0.249587 0.616548
C 3.003713 -2.958836 -0.679514
C 3.835153 2.558102 1.322689
H -2.259985 0.918311 1.393162
H -2.262584 1.709219 -0.203416
H -5.846185 1.439083 -0.035333
H -4.574416 2.523469 0.580721
H -3.753550 -1.038385 1.559509
H -4.833266 0.269914 2.099856
H -1.838644 -0.451193 -1.357753
H -1.940207 -1.348072 0.186782
H -3.528959 2.541070 -1.773848
H -4.840473 1.461358 -2.326428
H -5.213688 3.127837 -1.768273
H -6.588301 -0.550838 0.402465
H -5.459179 -1.844008 -0.089063
H -6.131217 -1.813927 1.576968
H 1.438591 1.343630 0.649387
H 5.307856 -1.730862 -0.002174
H 5.701203 0.576963 0.840451
H 2.337810 -3.556369 -0.032738
H 2.537516 -2.983650 -1.679959
H 3.990076 -3.451835 -0.731208
H 2.887975 3.112856 1.433289
H 4.338334 2.549936 2.307878
H 4.482621 3.131366 0.632449


