%chk=000029707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029707

0 1
 O   0.3412000       1.208700     -0.4609000    
 O  -0.6799000       2.406900       1.218600    
 N    3.568800     -2.0099999E-02  0.1267000    
 N   -4.997600      -2.072100     -0.3085000    
 N    4.628100      -1.411400       1.648200    
 N    3.986300      -2.340800     -0.3316000    
 C    2.514300       1.567700      -1.402200    
 C    1.490600       2.040800     -0.3773000    
 C    2.939000      0.1218000      -1.186800    
 C   -1.809600      0.5645000      0.2115000    
 C  -0.6742000       1.503100      0.3973000    
 C   -3.090100       1.006800      0.4726000    
 C   -1.548600     -0.7213000     -0.2160000    
 C   -3.919300      -1.180300     -0.1327000    
 C   -4.156500      0.1248000      0.2987000    
 C   -2.615100      -1.603500     -0.3900000    
 C    4.022500      -1.195700      0.4326000    
 H    2.082900       1.651500      -2.407000    
 H    3.391000       2.224700      -1.362200    
 H    1.906300       2.003400      0.6360000    
 H    1.207200       3.075700     -0.6025000    
 H    2.070100     -0.5414000      -1.272400    
 H    3.650900     -0.1451000      -1.977600    
 H   -3.287800       2.021400      0.8055000    
 H  -0.5419000      -1.079400     -0.4097000    
 H   -5.168300      0.4666000      0.5019000    
 H   -2.416900      -2.618900     -0.7236000    
 H   -4.826100      -3.018300     -0.6219000    
 H   -5.943300      -1.765800     -0.1228000    
 H    4.730300     -0.6609000       2.322700    
 H    4.990100      -2.322900       1.906100    
 H    4.375600      -3.211600      1.3400000E-02
 H    3.572900      -2.361100      -1.257000    


%chk=000029707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029707

0 1
O 0.300486 1.029227 -0.597412
O -0.649200 2.296035 1.117521
N 3.759534 -0.048444 0.221766
N -5.458719 -1.814129 -0.422546
N 5.250210 -0.966456 1.791694
N 4.457497 -2.372575 0.085179
C 2.555152 1.275988 -1.462530
C 1.551276 1.837033 -0.457853
C 3.051095 -0.132910 -1.072162
C -1.944243 0.520216 0.063599
C -0.745419 1.367223 0.271212
C -3.084365 0.745796 0.881702
C -2.002360 -0.503164 -0.920874
C -4.306600 -1.049678 -0.262826
C -4.247522 -0.021582 0.727135
C -3.161453 -1.277378 -1.085456
C 4.431520 -1.088234 0.655249
H 2.100792 1.256811 -2.471903
H 3.426314 1.957885 -1.491725
H 1.930458 1.734043 0.573208
H 1.300798 2.895738 -0.650636
H 2.164384 -0.804601 -1.010132
H 3.706150 -0.523857 -1.887227
H -3.031223 1.536776 1.637493
H -1.127526 -0.676780 -1.554030
H -5.118841 0.165245 1.366661
H -3.193319 -2.062532 -1.850979
H -5.507052 -2.544606 -1.126899
H -6.275437 -1.652871 0.159811
H 5.278916 -0.027967 2.188163
H 5.310955 -1.749165 2.442248
H 5.244613 -2.995115 0.252049
H 3.826028 -2.588172 -0.680403


