%chk=000133400.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133400

0 1
 O  -0.6906000       1.767100     -0.5964000    
 O   -2.841100      0.3311000      0.4349000    
 O    1.991600      -1.502700       1.499800    
 O    6.057500      -1.840100     -0.8171000    
 O   -4.290100      0.4066000       2.222100    
 N    1.924900       1.326000      0.5286000    
 N    4.931200      0.1953000     -0.8687000    
 N    4.029800      -1.695900      0.3467000    
 N    3.525300       2.211500     -0.7460000    
 N   -5.645100     -0.7696000      -2.194400    
 C   0.7015000       1.247200       1.290600    
 C    2.845400      0.3374000      0.3294000    
 C  -0.4882000      0.8021000      0.4378000    
 C    3.813300      0.9056000     -0.4529000    
 C    2.869900      -1.010800      0.7965000    
 C    2.378200       2.434800     -0.1383000    
 C   -1.760300      0.7191000       1.276000    
 C    5.083700      -1.158400     -0.4773000    
 C    5.940800      0.8369000      -1.701700    
 C    4.169200      -3.088100      0.7613000    
 C   -4.054400      0.2121000       1.039700    
 C   -5.091600     -0.1971000      5.9200000E-02
 C   -6.390700     -0.3744000      0.4705000    
 C   -4.750500     -0.3968000      -1.251800    
 C   -7.339900     -0.7579000     -0.4704000    
 C   -6.919800     -0.9409000      -1.778000    
 H   0.8607000      0.5834000       2.145300    
 H   0.5227000       2.252000       1.694800    
 H  -0.2880000     -0.1578000     -5.1899999E-02
 H    1.835600       3.370400     -0.1456000    
 H   -1.990900       1.700900       1.707300    
 H   -1.636700     -1.5300000E-02   2.080400    
 H    5.472100       1.173600      -2.631400    
 H    6.756900      0.1524000      -1.946200    
 H    6.350800       1.696900      -1.163300    
 H    3.337800      -3.431900       1.380600    
 H    5.104100      -3.193500       1.321000    
 H    4.235400      -3.714100     -0.1343000    
 H   -1.463500       1.481400      -1.113000    
 H   -6.695100     -0.2247000       1.501600    
 H   -3.745900     -0.2739000      -1.640900    
 H   -8.375800     -0.9088000     -0.1892000    
 H   -7.621300      -1.240000      -2.549800    


%chk=000133400-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133400

0 1
O -0.879520 2.058158 -0.268173
O -2.931837 0.231463 0.362410
O 2.398085 -1.563181 1.853010
O 6.435413 -1.677586 -0.585718
O -4.306193 -0.138405 2.207670
N 1.870758 1.150503 0.396848
N 5.027848 0.169472 -0.929739
N 4.422172 -1.592236 0.613359
N 3.368275 2.003421 -1.107635
N -6.045960 -0.226599 -2.355332
C 0.668374 1.003196 1.239322
C 2.939603 0.239462 0.324863
C -0.598834 0.778821 0.401234
C 3.835249 0.796185 -0.602218
C 3.170999 -1.006619 1.005559
C 2.174547 2.181440 -0.478968
C -1.773223 0.362251 1.291477
C 5.362915 -1.063556 -0.322731
C 5.950050 0.779985 -1.907842
C 4.804385 -2.884533 1.228589
C -4.171102 -0.031660 0.966410
C -5.266864 -0.163247 -0.033618
C -6.591272 -0.359787 0.435871
C -5.046096 -0.108947 -1.435772
C -7.633156 -0.484327 -0.504023
C -7.316395 -0.408433 -1.881868
H 0.848236 0.141828 1.905694
H 0.534280 1.917322 1.844804
H -0.415493 -0.016955 -0.350567
H 1.498562 3.015669 -0.641164
H -2.010287 1.126774 2.052649
H -1.597211 -0.608849 1.787824
H 5.448045 0.887908 -2.883793
H 6.823559 0.118626 -1.999742
H 6.260651 1.779098 -1.559776
H 4.002752 -3.164918 1.927107
H 5.763923 -2.779675 1.760393
H 4.925226 -3.653457 0.448157
H -1.716111 1.960392 -0.790846
H -6.772721 -0.410402 1.514320
H -4.035868 0.024871 -1.833762
H -8.668282 -0.636100 -0.184532
H -8.098583 -0.496272 -2.644252


