%chk=000073404.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073404

0 1
 O   -4.057400       1.526100     -0.6316000    
 O    2.625700       2.530600     -0.2094000    
 N  -0.9680000     -0.2709000     -0.6377000    
 N    1.673800      0.5056000      0.4277000    
 C  -0.4909000      0.4328000       1.724100    
 C   0.4624000      -1.672000      0.8587000    
 C   -1.467400      0.5037000      0.5152000    
 C  -0.1619000      -1.015000       2.091700    
 C    1.809000     -0.9632000      0.5344000    
 C  -0.5760000      -1.640500     -0.2861000    
 C   0.8277000       1.168900       1.427500    
 C   -2.904500      0.1000000      0.9214000    
 C    2.509200      -1.591000     -0.6726000    
 C   -1.885100     -0.2164000      -1.780200    
 C   -3.870900      0.1618000     -0.2615000    
 C   -3.322300     -0.6277000      -1.447700    
 C    3.790200     -0.8308000     -0.9575000    
 C    2.567600       1.300700     -0.2975000    
 C    3.438800      0.5973000      -1.319100    
 H  -0.9612000      0.9228000       2.586100    
 H   0.6753000      -2.723300       1.092300    
 H   -1.506400       1.557500      0.2050000    
 H   0.5329000      -1.049200       2.940100    
 H   -1.059800      -1.558200       2.405400    
 H    2.469300      -1.111500       1.401800    
 H  -0.1636000      -2.147700      -1.165000    
 H   -1.448200      -2.233200      1.7500000E-02
 H   0.6203000       2.198800       1.114800    
 H    1.428000       1.235500       2.344000    
 H   -2.923700     -0.9130000       1.337900    
 H   -3.251500      0.7809000       1.708800    
 H    1.877600      -1.556700      -1.566800    
 H    2.734800      -2.644300     -0.4711000    
 H   -1.505300     -0.8352000      -2.602500    
 H   -1.887400      0.8098000      -2.169800    
 H   -4.848000     -0.2326000      3.7400000E-02
 H   -3.947300     -0.4573000      -2.332300    
 H   -3.361200      -1.700500      -1.225100    
 H    4.332400      -1.301900      -1.784700    
 H    4.447700     -0.8519000     -8.0200002E-02
 H    2.904500      0.6260000      -2.276400    
 H    4.362400       1.175200      -1.438400    
 H   -4.679800       1.544500      -1.378400    


%chk=000073404-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073404

0 1
O -3.937502 1.675932 -0.623507
O 2.130487 2.528516 -0.481414
N -0.940185 -0.322304 -0.601209
N 1.704880 0.457553 0.498477
C -0.482722 0.393468 1.762228
C 0.485339 -1.728326 0.893421
C -1.438950 0.495730 0.543847
C -0.189533 -1.082070 2.125666
C 1.853836 -1.021061 0.616507
C -0.535089 -1.702485 -0.272139
C 0.865113 1.114655 1.527216
C -2.910869 0.142413 0.922577
C 2.608195 -1.636053 -0.579927
C -1.817215 -0.186907 -1.785085
C -3.846158 0.231735 -0.298677
C -3.294085 -0.576784 -1.497551
C 3.804283 -0.759418 -0.992240
C 2.322238 1.267972 -0.446607
C 3.262440 0.605235 -1.456603
H -0.975261 0.901866 2.615302
H 0.723937 -2.790466 1.108084
H -1.443599 1.547220 0.194908
H 0.478095 -1.127864 3.009124
H -1.113144 -1.631295 2.390464
H 2.468144 -1.208876 1.531054
H -0.108142 -2.157752 -1.186461
H -1.388320 -2.366577 0.033061
H 0.719393 2.155995 1.195084
H 1.424095 1.138935 2.489049
H -2.976976 -0.880190 1.342199
H -3.278018 0.844365 1.694900
H 1.931183 -1.735037 -1.449364
H 2.929904 -2.655704 -0.295269
H -1.408790 -0.807083 -2.605320
H -1.784046 0.869728 -2.113509
H -4.857427 -0.141066 -0.025259
H -3.921469 -0.403354 -2.396273
H -3.363996 -1.657586 -1.261377
H 4.383470 -1.241624 -1.801643
H 4.492356 -0.624855 -0.133980
H 2.701407 0.487352 -2.405468
H 4.068463 1.332241 -1.655625
H -4.503959 1.788329 -1.428460


