%chk=000146598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146598

0 1
 O    1.592200       1.908200      0.1890000    
 O    3.853800      -3.056500     -0.2439000    
 O    5.101600      -1.281800      0.8045000    
 O   -2.448900      -1.100000      -2.429300    
 O   -4.183900      -2.922600       1.618300    
 N  -0.1859000       3.471500      9.4300002E-02
 C  -0.3743000       1.373500      -1.200900    
 C   0.1737000       2.061600      6.7599997E-02
 C  -7.3100001E-02 -0.1482000      -1.129000    
 C   0.2996000       4.148800       1.296300    
 C   -1.633800       3.678600      0.1006000    
 C  -0.4963000       5.445600       1.301300    
 C   -1.768500       5.135400      0.5185000    
 C    1.315600     -0.4059000     -0.5740000    
 C   0.2082000       1.965000      -2.498600    
 C    2.053700      0.6242000      5.1100001E-02
 C   -1.187700     -0.8971000     -0.4013000    
 C    1.886500      -1.685600     -0.7002000    
 C    3.348400      0.3931000      0.5313000    
 C   -2.312900      -1.331400      -1.093500    
 C    3.158400      -1.887400     -0.2050000    
 C   -1.059000      -1.137000      0.9626000    
 C    3.869800     -0.8755000      0.3931000    
 C   -3.322000      -2.013700     -0.4137000    
 C   -2.067900      -1.819200       1.642300    
 C   -3.199400      -2.257500      0.9543000    
 C    5.083300      -2.666400      0.4011000    
 C   -3.637000      -1.582900      -3.052900    
 C   -3.994200      -3.137000       3.016100    
 H   -1.462100       1.495800      -1.267600    
 H  -0.2705000       1.584700      0.9524000    
 H  -4.6300001E-02 -0.5378000      -2.157300    
 H    1.375800       4.345900       1.260900    
 H   7.7900000E-02   3.576500       2.206400    
 H   -2.139300       3.035600      0.8325000    
 H   -2.096200       3.530600     -0.8799000    
 H   6.0600001E-02   6.246300      0.8007000    
 H  -0.7180000       5.777100       2.320700    
 H   -2.666100       5.297700       1.123900    
 H   -1.832000       5.789600     -0.3591000    
 H  -0.2105000       1.455600      -3.373600    
 H  -3.8899999E-02   3.027100      -2.594800    
 H    1.297400       1.867500      -2.544200    
 H    1.345800      -2.495800      -1.179000    
 H    3.923200       1.184900       1.000100    
 H  -0.2002000     -0.8002000       1.534600    
 H   -4.226400      -2.380900     -0.8871000    
 H   -1.910100      -1.972300       2.704500    
 H    5.228200      -3.292700       1.288800    
 H    5.914000      -2.840800     -0.2924000    
 H   -4.531400      -1.094300      -2.651300    
 H   -3.701500      -2.675500      -3.008500    
 H   -3.576900      -1.312000      -4.112200    
 H   -4.872000      -3.679800       3.381800    
 H   -3.951400      -2.190900       3.566100    
 H   -3.122400      -3.770700       3.211300    


%chk=000146598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146598

0 1
O 1.494892 1.865028 0.287205
O 4.145853 -3.016365 -0.322893
O 5.285831 -1.199462 0.769305
O -2.517904 -0.856206 -2.263761
O -4.330894 -2.925429 1.734491
N -0.261858 3.398357 0.093371
C -0.367345 1.271273 -1.258711
C 0.020904 1.969742 0.060033
C -0.053668 -0.259267 -1.114426
C 0.083992 4.063758 1.380073
C -1.670804 3.785610 -0.187126
C -0.549958 5.469881 1.241766
C -1.724687 5.281960 0.222314
C 1.355904 -0.465155 -0.564307
C 0.343645 1.892307 -2.479257
C 2.048818 0.587726 0.093890
C -1.138653 -0.984389 -0.307175
C 2.009315 -1.721901 -0.736812
C 3.380980 0.437313 0.577816
C -2.399320 -1.267274 -0.921327
C 3.307896 -1.866394 -0.257051
C -0.975483 -1.381748 1.034562
C 3.980353 -0.803233 0.383361
C -3.435745 -1.912205 -0.218845
C -1.998302 -2.029090 1.769304
C -3.231217 -2.290411 1.131475
C 5.422689 -2.611818 0.317667
C -3.766716 -1.166329 -2.962996
C -4.179092 -3.348047 3.128202
H -1.459939 1.369128 -1.390878
H -0.456968 1.428713 0.921475
H -0.089406 -0.671074 -2.141900
H 1.175642 4.081930 1.517349
H -0.364087 3.514497 2.248072
H -2.393273 3.189708 0.427178
H -1.922379 3.630451 -1.250403
H 0.189096 6.185792 0.843865
H -0.896160 5.851446 2.218134
H -2.706294 5.538142 0.658105
H -1.571956 5.926495 -0.660105
H -0.053807 1.455259 -3.413327
H 0.196546 2.985776 -2.501491
H 1.431738 1.707542 -2.446169
H 1.492629 -2.546659 -1.236552
H 3.885081 1.270198 1.071384
H -0.010070 -1.197053 1.518183
H -4.403086 -2.139782 -0.673532
H -1.816804 -2.319374 2.807604
H 5.604076 -3.251700 1.199143
H 6.235705 -2.670258 -0.427561
H -4.629836 -0.662335 -2.486444
H -3.947979 -2.258020 -2.995029
H -3.628675 -0.781329 -3.984221
H -5.139651 -3.813624 3.394080
H -3.986566 -2.483298 3.792830
H -3.362305 -4.087804 3.237762


