%chk=000146345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146345

0 1
 O   -2.962500      0.6891000      -1.268000    
 O   -6.430400      -1.543600      -1.091000    
 O  -0.4854000     -0.5696000       1.579400    
 O    3.262000     -0.1823000      -1.597400    
 O    2.325900       3.582300      -1.331700    
 O   0.2129000       4.362700      -1.050700    
 O   0.2010000      -4.120000      0.3855000    
 O   -1.335500      -2.697800     -0.4986000    
 O    5.167700      7.8699999E-02   1.432100    
 O    7.226100     -0.2075000      0.5215000    
 N   -5.398800      0.4605000     -0.4571000    
 N   -2.153800       1.401100      0.7959000    
 N   0.8567000     -0.1185000     -0.2612000    
 N    4.000600      -1.736400     -3.9799999E-02
 C   -4.482900      0.9049000      0.5551000    
 C   -4.563200     -0.1770000       1.615200    
 C  -0.7654000       1.539200      0.4283000    
 C   -4.964500      -1.433400      0.8430000    
 C   -3.136000      0.9862000     -8.8900000E-02
 C  -8.6099997E-02   2.621500       1.276000    
 C   -5.713700     -0.8898000     -0.3489000    
 C  -0.1423000      0.1680000      0.6572000    
 C    1.624700      -1.342400     -0.2392000    
 C    1.268000       3.087800      0.7360000    
 C   0.9894000      -2.430000      -1.101300    
 C    3.031300      -1.018100     -0.7259000    
 C    1.176300       3.741000     -0.6249000    
 C  -0.1764000      -3.077400     -0.3950000    
 C    5.414000      -1.570500     -0.2864000    
 C    6.040300     -0.5088000      0.5807000    
 H   -4.786100       1.889500      0.9231000    
 H   -3.647000     -0.3325000       2.192200    
 H   -5.362300      6.9899999E-02   2.325900    
 H  -0.7277000       1.789100     -0.6376000    
 H   -4.086700      -1.981200      0.4870000    
 H   -5.601200      -2.090900       1.439700    
 H   -5.751300       1.055300      -1.200600    
 H   5.3500000E-02   2.258100       2.302400    
 H  -0.7510000       3.492800       1.346300    
 H   -2.406400       1.575300       1.764700    
 H    1.678200      -1.677800      0.8044000    
 H    1.957800       2.239000      0.6824000    
 H    1.702700       3.824200       1.421200    
 H    1.053900      0.5522000     -0.9987000    
 H   0.6337000      -2.032400      -2.059700    
 H    1.712800      -3.216300      -1.350700    
 H    3.721000      -2.399000      0.6775000    
 H    5.568800      -1.300300      -1.335100    
 H    5.895200      -2.527900     -6.8099998E-02
 H    2.276800       4.014800      -2.210900    
 H  -0.5629000      -4.527400      0.8467000    
 H    5.599000      0.7649000       1.984600    


%chk=000146345-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146345

0 1
O -1.654298 0.152163 -1.162726
O -5.446165 -1.108602 -2.754627
O 1.153430 0.168323 2.403771
O 3.089925 -3.395318 -0.266702
O 3.259180 3.958539 -0.362782
O 1.063399 4.703603 -0.435630
O -0.492848 -4.041591 2.477553
O -2.028386 -2.851536 1.211004
O 3.754091 1.349892 -0.679681
O 5.876164 0.993010 -1.576479
N -4.470651 0.549685 -1.392975
N -1.616046 1.383589 0.800008
N 0.530520 -0.796597 0.363123
N 3.026799 -1.091392 -0.646098
C -3.824259 0.707560 -0.094612
C -4.333896 -0.555716 0.699011
C -0.143332 1.539760 0.786287
C -4.699084 -1.578784 -0.401066
C -2.282991 0.722334 -0.210777
C 0.284648 2.749848 1.641151
C -4.937907 -0.740108 -1.665269
C 0.567847 0.238156 1.280289
C 1.173739 -2.093899 0.614339
C 1.751066 3.165510 1.385275
C 0.233388 -3.292157 0.311872
C 2.519815 -2.268239 -0.166164
C 1.918675 4.000592 0.131534
C -0.887847 -3.358566 1.323058
C 4.365796 -0.920609 -1.200918
C 4.779187 0.552080 -1.181253
H -4.150757 1.641152 0.405229
H -3.573140 -0.950219 1.389817
H -5.227673 -0.266113 1.278300
H 0.134785 1.696818 -0.275272
H -3.863148 -2.274582 -0.589875
H -5.593365 -2.178066 -0.167992
H -4.388771 1.239138 -2.141406
H 0.185389 2.482347 2.708175
H -0.379343 3.604933 1.417342
H -2.139444 1.790737 1.578739
H 1.455873 -2.111370 1.685666
H 2.422614 2.291033 1.363885
H 2.109206 3.795783 2.224021
H -0.088744 -0.665816 -0.461135
H -0.201823 -3.191508 -0.696817
H 0.850762 -4.204481 0.353830
H 2.492590 -0.232547 -0.494790
H 4.434991 -1.277647 -2.247591
H 5.104631 -1.511902 -0.627880
H 3.354045 4.612426 -1.107955
H -1.232547 -4.033969 3.144161
H 3.934709 2.341624 -0.632364


