%chk=000124727.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124727

0 1
 O    4.939500      -1.190100       1.424500    
 N    4.909400      -1.151200      5.0099999E-02
 C    4.401500      0.1731000     -0.4049000    
 C    2.960800      0.3908000      6.8499997E-02
 C    2.332800       1.731200     -0.3341000    
 C   0.9104000       1.982200      0.1766000    
 C  -0.1583000       1.006700     -0.3260000    
 C   -1.548700       1.276600      0.2551000    
 C    5.329400       1.258500      0.1260000    
 C   -2.575600      0.2778000     -0.2854000    
 C    4.007800      -2.250500     -0.4467000    
 C    6.303400      -1.378800     -0.4726000    
 C   -3.994000      0.5187000      0.2397000    
 C   -5.025800     -0.4642000     -0.3203000    
 C   -6.424000     -0.1678000      0.2288000    
 C   -7.491300      -1.143800     -0.2711000    
 C   -8.877200     -0.8692000      0.2919000    
 H    4.433200      0.1623000      -1.501800    
 H    2.315400     -0.3853000     -0.3517000    
 H    2.896200      0.2918000       1.159300    
 H    2.339800       1.815200      -1.427800    
 H    2.944200       2.555200      4.7899999E-02
 H   0.6167000       3.000200     -0.1089000    
 H   0.9244000       1.960800       1.273700    
 H   0.1296000     -1.8400000E-02 -6.7000002E-02
 H  -0.2011000       1.058300      -1.420800    
 H   -1.511500       1.210400       1.348900    
 H   -1.859800       2.297200      2.0000001E-03
 H    5.011200       2.249300     -0.2122000    
 H    6.353600       1.164400     -0.2447000    
 H    5.365600       1.282200       1.220200    
 H   -2.264500     -0.7407000     -2.1700000E-02
 H   -2.588400      0.3311000      -1.381200    
 H   -3.985500      0.4511000       1.334600    
 H   -4.298100       1.542400     -1.1800000E-02
 H    4.512600      -3.202400     -0.2556000    
 H    3.846300      -2.109500      -1.518300    
 H    3.077800      -2.239400      0.1256000    
 H    6.311500      -1.172000      -1.545500    
 H    6.559300      -2.425600     -0.2820000    
 H    7.005800     -0.7537000      8.2099997E-02
 H   -4.736000      -1.488600     -5.7599999E-02
 H   -5.039900     -0.4013000      -1.414800    
 H   -6.396000     -0.2021000       1.325100    
 H   -6.713700      0.8534000     -4.8300002E-02
 H   -7.538100      -1.100300      -1.365700    
 H   -7.199700      -2.167200     -6.2000002E-03
 H   -8.876400     -0.9433000       1.383900    
 H   -9.597400      -1.594700     -9.8899998E-02
 H   -9.218500      0.1335000      1.5799999E-02


%chk=000124727-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124727

0 1
O 5.352357 -0.972836 1.430821
N 5.038553 -1.125925 0.050392
C 4.370256 0.207157 -0.529121
C 3.045401 0.450908 0.226161
C 2.356216 1.795506 -0.112855
C 0.931827 1.918747 0.486385
C -0.120445 0.979669 -0.149300
C -1.550141 1.224856 0.384336
C 5.381809 1.348157 -0.348713
C -2.601846 0.272029 -0.227276
C 4.089613 -2.308391 -0.118373
C 6.318041 -1.435108 -0.721934
C -4.038224 0.534123 0.278470
C -5.083310 -0.432179 -0.323724
C -6.523926 -0.164733 0.166901
C -7.564461 -1.138536 -0.432139
C -9.002157 -0.864604 0.059523
H 4.173452 0.005270 -1.603342
H 2.335135 -0.362771 -0.008921
H 3.275804 0.391107 1.308248
H 2.294990 1.924300 -1.215065
H 2.969936 2.633144 0.269756
H 0.585833 2.965754 0.363414
H 0.978104 1.732951 1.579567
H 0.152623 -0.079630 0.033946
H -0.112999 1.118750 -1.251331
H -1.553187 1.114691 1.489022
H -1.842329 2.275824 0.176906
H 4.900566 2.322476 -0.528797
H 6.236121 1.273681 -1.043065
H 5.751187 1.307643 0.692972
H -2.319785 -0.777732 -0.000143
H -2.581209 0.365896 -1.333570
H -4.058449 0.452126 1.385470
H -4.325693 1.579751 0.039869
H 4.646943 -3.209737 0.176582
H 3.722652 -2.395831 -1.158664
H 3.259875 -2.165347 0.584169
H 6.134878 -1.494958 -1.811429
H 6.699396 -2.391438 -0.334642
H 7.043443 -0.647601 -0.485698
H -4.800332 -1.476996 -0.075821
H -5.054533 -0.358070 -1.431326
H -6.554486 -0.234033 1.274641
H -6.811358 0.877564 -0.086272
H -7.531346 -1.070099 -1.538901
H -7.276972 -2.179271 -0.177272
H -9.068686 -0.955708 1.160297
H -9.725164 -1.574874 -0.382460
H -9.325275 0.158629 -0.210995


