%chk=000178875.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178875

0 1
 O   -2.933100       2.125100     -0.3833000    
 O   -2.515000      -3.624400     -5.2600000E-02
 O   -4.173500      0.5351000      0.7071000    
 O   -4.125900      -1.997100      6.1299998E-02
 O    6.424600      -1.015600      0.9650000    
 N   0.1342000     -0.6609000      4.4199999E-02
 N  -0.5838000      -1.796300      1.1000000E-03
 C  -0.6243000      0.4734000      0.1175000    
 C   -1.931900      4.3800000E-02  0.1219000    
 C    1.528200     -0.7288000      1.2700000E-02
 C  -8.1299998E-02   1.808600      0.1752000    
 C   -1.845100      -1.359400      4.8900001E-02
 C    2.235600     -0.8232000       1.203600    
 C    2.187400     -0.7005000      -1.208900    
 C   -3.096300      0.8779000      0.1877000    
 C   0.1565000       2.517100      -1.002700    
 C   0.2054000       2.391600       1.409500    
 C    4.300700     -0.8631000     -4.9800001E-02
 C    3.628500     -0.8906000       1.172100    
 C    3.580200     -0.7681000      -1.240300    
 C   -2.923200      -2.307900      2.2000000E-02
 C   0.6808000       3.808400     -0.9461000    
 C   0.7295000       3.683100       1.466100    
 C   0.9673000       4.391300      0.2884000    
 C    5.753100     -0.9307000     -8.2599998E-02
 C   -4.058500       3.010200     -0.3526000    
 C   -3.540400      -4.623700     -8.2900003E-02
 C    6.494300     -0.8983000      -1.414900    
 C   -3.679200       4.313600      -1.022600    
 C   -2.894700      -5.990500     -0.1647000    
 H    1.723000     -0.8453000       2.161900    
 H    1.636600     -0.6263000      -2.143100    
 H  -6.1999999E-02   2.077300      -1.973000    
 H   2.5500000E-02   1.852900       2.336900    
 H    4.167700     -0.9635000       2.112900    
 H    4.063000     -0.7430000      -2.212200    
 H   0.8654000       4.360300      -1.863100    
 H   0.9524000       4.137100       2.427200    
 H    1.375100       5.396900      0.3325000    
 H   -4.345000       3.197100      0.6881000    
 H   -4.897600       2.549200     -0.8848000    
 H   -4.179700      -4.462000     -0.9577000    
 H   -4.144400      -4.552200      0.8282000    
 H    6.295200      4.1999999E-02  -1.935500    
 H    6.209700      -1.758100      -2.026900    
 H    7.571000     -0.9589000      -1.226800    
 H   -3.368000       4.138400      -2.057700    
 H   -2.829500       4.776600     -0.5100000    
 H   -4.518600       5.014400      -1.019200    
 H   -2.236900      -6.157800      0.6946000    
 H   -2.271700      -6.069200      -1.061700    
 H   -3.651200      -6.779700     -0.1895000    


%chk=000178875-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178875

0 1
O -3.157450 1.983666 -0.808929
O -2.686851 -3.482545 0.309924
O -3.990781 0.654955 0.916067
O -4.006437 -1.944514 -0.852117
O 6.474909 -2.439311 0.230160
N 0.271341 -0.609100 -0.071613
N -0.503627 -1.769649 -0.107773
C -0.509958 0.561462 -0.049715
C -1.847951 0.117906 -0.089440
C 1.697212 -0.767482 -0.140391
C 0.055195 1.913821 0.166426
C -1.787602 -1.317473 -0.110868
C 2.277582 -1.917316 0.452828
C 2.504366 0.170442 -0.828028
C -3.092355 0.909125 0.081077
C -0.261094 2.985993 -0.708452
C 0.916931 2.153229 1.272420
C 4.498754 -1.165279 -0.287746
C 3.666382 -2.106595 0.378729
C 3.896310 -0.030395 -0.892280
C -2.938992 -2.244377 -0.264460
C 0.285521 4.269112 -0.487138
C 1.456231 3.437356 1.492622
C 1.145986 4.499876 0.610917
C 5.980687 -1.417070 -0.330689
C -4.391481 2.826937 -0.703096
C -3.777148 -4.497883 0.156111
C 6.876998 -0.422625 -1.061597
C -4.252772 3.943083 -1.733019
C -3.322486 -5.742224 0.910057
H 1.628309 -2.643421 0.948335
H 2.052160 1.036679 -1.316792
H -0.936239 2.807009 -1.549518
H 1.151889 1.336849 1.964246
H 4.141193 -2.982106 0.833212
H 4.507931 0.701220 -1.429625
H 0.039420 5.087460 -1.172732
H 2.112557 3.609707 2.352355
H 1.567149 5.496797 0.781583
H -4.464522 3.207527 0.331500
H -5.263226 2.176187 -0.894547
H -3.924354 -4.683338 -0.923563
H -4.709702 -4.067029 0.562946
H 6.792656 0.588840 -0.622235
H 6.596581 -0.345383 -2.128788
H 7.921416 -0.760886 -0.988257
H -4.155317 3.529876 -2.751563
H -3.369465 4.570067 -1.520071
H -5.149394 4.588785 -1.705710
H -3.169146 -5.519496 1.979608
H -2.376187 -6.130091 0.496221
H -4.091027 -6.532078 0.824809


