%chk=000227170.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227170

0 1
 O    5.281100      -2.964700      -1.048800    
 O    5.265400       3.199900     -0.7513000    
 O    3.312400      -1.903500      -1.449300    
 O    3.485900       2.008500      -1.510200    
 N    4.007400      5.4000001E-02  0.3501000    
 C   -1.348700     -0.3444000      0.4748000    
 C   -2.753200      5.6200001E-02  0.9352000    
 C  -0.2654000     -7.5700000E-02   1.521800    
 C   -3.846800     -0.2800000     -8.2400002E-02
 C    1.119900     -0.4643000      0.9983000    
 C   -5.233100      7.6800004E-02  0.4608000    
 C    2.207400     -0.1688000       2.035900    
 C   -6.367600     -0.2179000     -0.5250000    
 C    3.602400     -0.6058000       1.585200    
 C   -7.745200      0.2065000     -1.1600000E-02
 C   -8.828100     -4.3600000E-02  -1.062300    
 C    5.068800     -0.7038000     -0.3154000    
 C    4.453100       1.422600      0.6185000    
 C   -10.19410      0.4110000     -0.5737000    
 C    4.453400      -1.889900      -1.004800    
 C    4.325000       2.226900     -0.6456000    
 H   -1.108300      0.1998000     -0.4471000    
 H   -1.345100      -1.412000      0.2218000    
 H   -2.769600       1.132800       1.145100    
 H   -2.974300     -0.4539000       1.881100    
 H  -0.4887000     -0.6409000       2.434500    
 H  -0.2731000      0.9880000       1.788900    
 H   -3.812900      -1.349700     -0.3211000    
 H   -3.661100      0.2667000      -1.014300    
 H    1.130600      -1.531900      0.7472000    
 H    1.321500      8.9400001E-02  7.3899999E-02
 H   -5.414700     -0.4769000       1.390200    
 H   -5.253000       1.143100      0.7188000    
 H    2.191100      0.8959000       2.293800    
 H    1.967800     -0.7064000       2.962600    
 H   -6.378000      -1.291300     -0.7514000    
 H   -6.160100      0.3023000      -1.468600    
 H    3.562200      -1.695200       1.454300    
 H    4.327600     -0.4267000       2.390100    
 H   -7.981600     -0.3457000      0.9057000    
 H   -7.725400       1.272000      0.2479000    
 H   -8.582400      0.4924000      -1.986500    
 H   -8.868900      -1.111300      -1.307300    
 H    5.838000      -1.029200      0.3954000    
 H    5.559700     -0.1224000      -1.104900    
 H    5.487100       1.444100      0.9836000    
 H    3.828700       1.937900       1.355500    
 H   -10.48510     -0.1274000      0.3339000    
 H   -10.19500       1.483200     -0.3527000    
 H   -10.95300      0.2214000      -1.339200    
 H    4.857600      -3.734800      -1.484500    
 H    5.179400       3.702200      -1.589500    


%chk=000227170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227170

0 1
O 5.732769 -2.786618 -1.533733
O 4.552000 3.527568 -0.528430
O 3.525970 -2.640717 -0.825219
O 4.484622 1.702925 -1.962909
N 4.119607 -0.042742 0.371609
C -1.374426 -0.346981 0.522525
C -2.782280 0.061158 1.011626
C -0.258411 -0.055228 1.551088
C -3.897087 -0.230295 -0.018201
C 1.143084 -0.481833 1.061797
C -5.306612 0.169085 0.473603
C 2.253321 -0.183793 2.092366
C -6.420966 -0.120249 -0.557540
C 3.653328 -0.659765 1.645703
C -7.830999 0.276858 -0.065210
C -8.944731 -0.010452 -1.098173
C 5.161050 -0.813097 -0.320192
C 4.450453 1.378775 0.516149
C -10.349659 0.390915 -0.598659
C 4.665453 -2.138841 -0.885004
C 4.485124 2.150943 -0.798373
H -1.145529 0.184123 -0.424857
H -1.370670 -1.429579 0.277766
H -2.785667 1.143917 1.258164
H -3.010158 -0.472860 1.958237
H -0.494230 -0.578032 2.502620
H -0.255136 1.030494 1.787216
H -3.889614 -1.311820 -0.268891
H -3.672170 0.307866 -0.962904
H 1.146288 -1.566021 0.830674
H 1.387596 0.026051 0.109338
H -5.531929 -0.371137 1.417178
H -5.313671 1.250258 0.726424
H 2.260242 0.900805 2.330155
H 2.022220 -0.696170 3.049443
H -6.412814 -1.201068 -0.811655
H -6.196280 0.421241 -1.500519
H 3.601378 -1.748808 1.476170
H 4.391623 -0.484803 2.470414
H -8.057975 -0.265964 0.876483
H -7.840087 1.357394 0.190236
H -8.716447 0.530957 -2.039123
H -8.935559 -1.090312 -1.351833
H 6.053322 -1.041437 0.317273
H 5.527246 -0.233612 -1.185981
H 5.433185 1.567462 1.024772
H 3.691280 1.865109 1.151580
H -10.614049 -0.159759 0.324014
H -10.393477 1.471981 -0.366640
H -11.127111 0.175713 -1.354923
H 5.405015 -3.642888 -1.921042
H 4.602568 4.028780 -1.387214


