%chk=000152827.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152827

0 1
 O   -4.454000      0.5654000      -1.027500    
 O  -0.6748000       2.776000       1.527400    
 O   0.5969000      -2.659400       1.263400    
 O  -0.4962000      -2.370600     -0.7417000    
 N   -1.854100      2.6900001E-02 -1.6000000E-03
 N    3.676800      0.4404000     -0.9606000    
 C  -0.8475000      5.5300001E-02   1.057500    
 C   -2.271000       1.389200     -0.3621000    
 C   -3.021900     -0.7646000      0.4097000    
 C   0.3854000      0.8116000      0.6393000    
 C   -3.330200       1.333700      -1.459300    
 C   -4.062700     -0.7699000     -0.7063000    
 C    1.482800      0.2087000      8.8000000E-03
 C   0.3829000       2.172900      0.9161000    
 C    2.604400      0.9834000     -0.3539000    
 C    1.506800      -1.162500     -0.2800000    
 C    1.484300       2.942000      0.5617000    
 C    2.580100       2.345500     -6.6799998E-02
 C    2.610300      -1.724800     -0.9050000    
 C    3.660200     -0.8868000      -1.221600    
 C   0.4355000      -2.106300      2.4599999E-02
 C  -0.3939000      -3.606000       1.678000    
 H  -0.6561000     -0.8893000       1.544200    
 H   -1.290400      0.5757000       1.922400    
 H   -1.456700       1.978400     -0.7901000    
 H   -2.705000       1.907300      0.5015000    
 H   -3.467300     -0.3395000       1.318800    
 H   -2.736000      -1.798200      0.6273000    
 H   -3.686400       2.343600      -1.686900    
 H   -2.930500      0.9063000      -2.387300    
 H   -3.686300      -1.268700      -1.607900    
 H   -4.957500      -1.308800     -0.3788000    
 H    1.508800       4.009100      0.7660000    
 H    3.430600       2.969800     -0.3346000    
 H    2.662600      -2.781900      -1.143600    
 H    4.549500      -1.270000      -1.711300    
 H  -0.4874000       3.725100       1.626600    
 H  -0.6646000      -4.284900      0.8635000    
 H   -1.277000      -3.083900       2.054000    
 H   3.0300001E-02  -4.200400       2.492000    


%chk=000152827-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152827

0 1
O -3.986084 -0.303966 -1.623373
O -0.065949 2.872830 2.605342
O 0.034809 -2.123138 1.248703
O -0.628537 -2.673591 -0.921789
N -1.773690 0.006667 0.243277
N 3.232526 0.697206 -1.373701
C -1.052868 0.576401 1.411030
C -2.017839 0.991709 -0.846679
C -3.053733 -0.635286 0.650154
C 0.334028 1.082601 1.048281
C -2.706054 0.299857 -2.034129
C -3.730629 -1.295649 -0.563390
C 1.194155 0.444357 0.082571
C 0.776497 2.278547 1.644467
C 2.408683 1.133063 -0.343544
C 0.939744 -0.828082 -0.563604
C 2.015623 2.901601 1.300490
C 2.805106 2.346145 0.301602
C 1.755114 -1.219285 -1.636530
C 2.874796 -0.426280 -2.021256
C -0.049744 -1.876413 -0.138925
C -0.604702 -3.381845 1.696014
H -0.967200 -0.229798 2.163141
H -1.624198 1.409384 1.876344
H -1.053525 1.419716 -1.173672
H -2.660314 1.829336 -0.480361
H -3.748523 0.118784 1.095416
H -2.841259 -1.396678 1.423968
H -2.961403 1.029603 -2.819824
H -2.038518 -0.484058 -2.449072
H -3.086761 -2.107306 -0.957346
H -4.720422 -1.696950 -0.289216
H 2.320181 3.829899 1.801045
H 3.734803 2.812837 -0.034620
H 1.546965 -2.163753 -2.147535
H 3.515210 -0.737752 -2.854273
H 0.310762 3.732729 2.916853
H -0.104764 -4.246187 1.226359
H -1.674056 -3.403985 1.426722
H -0.467531 -3.393470 2.786960


