%chk=000148240.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148240

1 1
 O   -1.221700     -0.7549000     -0.9500000    
 O    3.146800     -0.1965000     -0.7100000    
 O   -1.944700      -2.674000      -1.989700    
 O   -1.694400      -3.869900       1.307000    
 O    3.130600      -1.901900      -2.248200    
 O   -1.591100       1.655200      0.1360000    
 N    1.280100      -1.429600     -0.9303000    
 N   -1.743000      -1.637100       3.024200    
 N   -2.651500      -1.301300       3.509500    
 C   0.3976000      -2.452100      -1.432700    
 C   0.5618000      -3.777100     -0.6725000    
 C   0.6822000      -3.673000      0.8579000    
 C   -1.053200      -1.993200      -1.493400    
 C  -0.5417000      -3.150400       1.554300    
 C    2.572200      -1.240000      -1.379600    
 C   -2.557000     -0.2400000     -0.9780000    
 C    4.495700      0.1140000      -1.077300    
 C  -0.5212000      -2.088600       2.372600    
 C   -2.596400       1.136700     -0.3441000    
 C    4.972600       1.274700     -0.2546000    
 C   -3.893700       1.871500     -0.3058000    
 C    4.788300       2.578500     -0.7151000    
 C    5.599700       1.050100      0.9711000    
 C   -5.040700       1.290300     -0.8468000    
 C   -3.960400       3.139600      0.2715000    
 C    5.231200       3.657600      4.9699999E-02
 C    6.042600       2.129400       1.735900    
 C    5.858300       3.433100       1.275100    
 C   -6.254200       1.977300     -0.8108000    
 C   -5.174000       3.826500      0.3076000    
 C   -6.320800       3.245200     -0.2336000    
 H   0.6766000      -2.626000      -2.480700    
 H  -0.2409000      -4.472000     -0.9468000    
 H    1.490900      -4.246900      -1.024200    
 H    1.563900      -3.075000       1.119800    
 H   0.8869000      -4.678300       1.249800    
 H   0.9394000     -0.8148000     -0.1971000    
 H   -3.204200     -0.9130000     -0.4056000    
 H   -2.875900     -0.1616000      -2.022700    
 H    5.136400     -0.7599000     -0.9059000    
 H    4.540700      0.3630000      -2.144800    
 H   0.3947000      -1.540400       2.563200    
 H   -1.455000      -4.682700      0.8312000    
 H    4.299100       2.766400      -1.667200    
 H    5.747000      3.9200000E-02   1.341700    
 H   -5.035100      0.3059000      -1.303500    
 H   -3.080900       3.612900      0.6995000    
 H    5.087200       4.672700     -0.3086000    
 H    6.530300       1.954700       2.690500    
 H    6.202900       4.273200       1.870800    
 H   -7.147600       1.525100      -1.231600    
 H   -5.226400       4.813800      0.7570000    
 H   -7.265600       3.780100     -0.2054000    


%chk=000148240-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148240

1 1
O -1.417986 -0.971553 -2.179897
O 2.885178 -0.113724 -0.282323
O -2.290797 -2.288254 -0.513555
O -2.264888 -3.756941 1.450168
O 2.933500 -2.283932 -1.214838
O -1.389110 0.600186 -0.077451
N 0.943343 -1.282589 -0.497317
N -2.185058 -5.241917 3.704191
N -3.192405 -5.595282 4.170194
C 0.145584 -2.393634 -1.037853
C 0.288513 -3.701545 -0.205937
C 0.195074 -3.521524 1.343386
C -1.286460 -1.890670 -1.189242
C -1.077858 -4.031117 1.967768
C 2.320273 -1.302850 -0.712924
C -2.576425 -0.056932 -2.092167
C 4.393195 -0.013641 -0.447038
C -1.031850 -4.822140 3.145143
C -2.343546 0.874631 -0.868321
C 4.781055 1.421171 -0.213534
C -3.253188 2.021338 -0.677906
C 4.745238 2.356713 -1.279026
C 5.194882 1.853416 1.071842
C -4.353706 2.261189 -1.551672
C -3.014823 2.907385 0.413218
C 5.109715 3.703277 -1.061697
C 5.561928 3.199411 1.291807
C 5.518698 4.126853 0.224906
C -5.198626 3.366424 -1.334930
C -3.860359 4.011455 0.622927
C -4.952964 4.242634 -0.249866
H 0.518438 -2.631404 -2.056884
H -0.421676 -4.463798 -0.577507
H 1.301378 -4.073885 -0.432010
H 0.298180 -2.435615 1.568607
H 1.053662 -4.007219 1.834930
H 0.476387 -0.405707 -0.231158
H -3.513360 -0.630618 -1.976337
H -2.571744 0.490527 -3.045568
H 4.843531 -0.700860 0.290040
H 4.633482 -0.370284 -1.463129
H -0.109757 -5.123396 3.642466
H -2.271192 -3.115972 0.556001
H 4.436437 2.028663 -2.279009
H 5.234405 1.134750 1.899654
H -4.560510 1.594393 -2.396199
H -2.163558 2.711689 1.073035
H 5.085270 4.417914 -1.891299
H 5.886876 3.523079 2.286376
H 5.809748 5.169565 0.392373
H -6.044187 3.549704 -2.005023
H -3.673753 4.693689 1.458079
H -5.609781 5.103448 -0.086196


