%chk=000071923.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071923

1 1
 O   0.5880000     -0.7238000      0.1466000    
 O   -2.235400      0.5629000       1.960800    
 O   0.3007000     -0.1444000       2.358700    
 N    3.941700      0.3169000      0.1107000    
 C    2.602700      -1.668500     -0.8440000    
 C    2.726100      3.7300002E-02   1.012000    
 C    1.925200      -1.129000      0.4247000    
 C    4.834400     -0.9324000      5.9200000E-02
 C    3.458200      0.6569000      -1.305000    
 C    4.021900      -2.112400     -0.4766000    
 C    2.709400     -0.5431000      -1.883200    
 C    4.734200       1.487000      0.6736000    
 C   -1.436000       1.385600     -0.1195000    
 C   -1.534200      0.1559000      0.7815000    
 C  -0.1239000     -0.2447000       1.214000    
 C   -2.834000       1.893000     -0.4981000    
 C  -0.6188000       2.492200      0.5610000    
 C   -2.762600       3.154400      -1.355900    
 C  -0.5512000       3.752500     -0.2985000    
 C   -1.942300       4.248800     -0.6802000    
 C   -2.289000      -1.036000      0.2084000    
 C   -3.033500      -1.825400       1.060200    
 C   -2.204700      -1.289700      -1.145100    
 C   -3.724600      -2.917300      0.5351000    
 C   -2.896100      -2.381500      -1.670200    
 C   -3.656100      -3.195300     -0.8301000    
 H    2.026800      -2.500500      -1.264100    
 H    2.177400      0.9784000       1.080400    
 H    3.123800     -0.2190000       2.001000    
 H    1.872200      -1.941900       1.161800    
 H    5.199000      -1.125100       1.074400    
 H    5.686700     -0.7036000     -0.5907000    
 H    4.337400      0.9090000      -1.908600    
 H    2.809300       1.537100      -1.230600    
 H    4.527500      -2.538300      -1.351700    
 H    3.989300      -2.910200      0.2752000    
 H    1.713300     -0.2288000      -2.217600    
 H    3.229200     -0.9047000      -2.779100    
 H    5.059400       1.229700       1.685800    
 H    5.598900       1.662000      2.7000001E-02
 H    4.086000       2.367900      0.6918000    
 H  -0.9003000       1.141800      -1.046500    
 H   -3.417000       2.124000      0.4024000    
 H   -3.402700       1.141300      -1.053900    
 H   0.4080000       2.176800      0.7547000    
 H   -1.056100       2.775300       1.525100    
 H   -3.775300       3.523500      -1.553900    
 H   -2.316000       2.909900      -2.327500    
 H   2.4599999E-02   3.543100      -1.208500    
 H  -1.5400000E-02   4.540400      0.2429000    
 H   -1.855300       5.111500      -1.350200    
 H   -2.466000       4.594400      0.2196000    
 H   -1.648000       1.103500       2.514000    
 H   -3.092200      -1.647000       2.129200    
 H   -1.608000     -0.6929000      -1.825000    
 H   -4.312700      -3.554100       1.189600    
 H   -2.838600      -2.601300      -2.732200    
 H   -4.192500      -4.046800      -1.238500    


%chk=000071923-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071923

1 1
O 0.734299 -0.524295 0.012718
O -2.008566 0.709040 2.092747
O 0.290926 -0.760440 2.277457
N 4.066836 0.339991 0.320560
C 2.721809 -1.387364 -1.098442
C 2.949371 -0.297251 1.168813
C 2.043436 -1.183130 0.270582
C 5.004051 -0.778576 -0.181349
C 3.421040 1.035164 -0.902046
C 4.158277 -1.910902 -0.829183
C 2.809230 -0.032090 -1.847330
C 4.838778 1.349094 1.151719
C -1.472665 1.338833 -0.189790
C -1.502768 0.161105 0.836366
C -0.099987 -0.407337 1.139482
C -2.900786 1.875918 -0.466517
C -0.551718 2.495074 0.277978
C -2.871215 3.022045 -1.505477
C -0.511973 3.639805 -0.763326
C -1.934105 4.169900 -1.064178
C -2.365946 -1.032998 0.343973
C -3.529194 -1.393587 1.064336
C -2.029361 -1.748237 -0.834148
C -4.342161 -2.459784 0.618300
C -2.845611 -2.810797 -1.280226
C -4.003034 -3.173674 -0.552920
H 2.150179 -2.117185 -1.692744
H 2.380694 0.518610 1.640182
H 3.436212 -0.885776 1.963411
H 1.850327 -2.141405 0.782342
H 5.585321 -1.128373 0.687805
H 5.697078 -0.304585 -0.896401
H 4.212115 1.632005 -1.385404
H 2.654525 1.718182 -0.498670
H 4.626941 -2.221273 -1.777605
H 4.132070 -2.800446 -0.175286
H 1.806796 0.295992 -2.161735
H 3.424836 -0.152793 -2.755093
H 5.188874 0.866915 2.077662
H 5.701509 1.711414 0.571419
H 4.177808 2.193570 1.401174
H -1.069823 0.924499 -1.137691
H -3.333844 2.240287 0.484479
H -3.551246 1.057926 -0.827010
H 0.479148 2.118974 0.465141
H -0.931239 2.878238 1.243692
H -3.896581 3.406707 -1.660562
H -2.529784 2.625429 -2.484648
H -0.057447 3.269291 -1.707798
H 0.131173 4.463419 -0.396036
H -1.891438 4.953425 -1.844149
H -2.344263 4.646343 -0.150940
H -1.718792 0.122395 2.841678
H -3.808608 -0.818830 1.952146
H -1.137313 -1.476153 -1.410027
H -5.243608 -2.725433 1.180827
H -2.582565 -3.353216 -2.195107
H -4.635220 -3.998352 -0.898755


