%chk=000134454.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134454

0 1
 O    4.087500       1.789200     -2.2500001E-02
 O  -8.7499999E-02 -0.4669000     -0.5152000    
 O    6.080400       2.885100      0.2147000    
 O  -0.2054000     -0.6799000       1.802700    
 N   -6.344200     -0.3093000      5.3199999E-02
 N   -8.105700       1.117800     -0.7872000    
 N   -5.915900       1.749700     -0.8721000    
 C    4.081600     -0.6426000     -0.2544000    
 C    3.396900      0.5715000     -0.1846000    
 C    5.547300     -0.6305000     -0.1554000    
 C    3.321800      -1.809000     -0.4156000    
 C    2.005500      0.6489000     -0.2699000    
 C    1.269400     -0.5202000     -0.4299000    
 C    1.926300      -1.747400     -0.5026000    
 C    6.177800      0.5424000     -1.7000000E-03
 C    6.312800      -1.919400     -0.2270000    
 C    5.469700       1.831400      7.3899999E-02
 C   -2.219900     -0.4985000      0.5399000    
 C  -0.7462000     -0.5642000      0.7131000    
 C   -2.985900      4.4199999E-02   1.550900    
 C   -2.776300     -0.9800000     -0.6272000    
 C   -4.956900     -0.3720000      0.2169000    
 C   -4.369800      0.1081000       1.387500    
 C   -4.160100     -0.9160000     -0.7906000    
 C   -6.803300      0.7679000     -0.4969000    
 H    3.793100      -2.786500     -0.4770000    
 H    1.504100       1.611000     -0.2124000    
 H    1.358300      -2.665700     -0.6282000    
 H    7.260000      0.5886000      7.4800000E-02
 H    7.393300      -1.758500     -0.1397000    
 H    6.138100      -2.423000      -1.183800    
 H    6.020100      -2.591500      0.5868000    
 H   -2.540200      0.4246000       2.465000    
 H   -2.178600      -1.419700      -1.419900    
 H   -4.981900      0.5336000       2.178600    
 H   -4.608400      -1.296400      -1.704800    
 H   -8.875400      0.4944000     -0.5693000    
 H   -8.331800       2.003600      -1.225900    
 H   -6.260500       2.600400      -1.305500    
 H   -4.911100       1.706400     -0.7553000    


%chk=000134454-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134454

0 1
O 4.407609 1.006847 -1.823716
O 0.135518 -0.239665 -0.212023
O 6.415066 1.709823 -2.717468
O -0.642163 -1.679652 1.496161
N -6.129536 0.729724 -1.108485
N -8.408810 1.144881 -0.964654
N -7.158355 1.168229 1.035192
C 4.360977 -0.667297 -0.007270
C 3.698013 0.212555 -0.917294
C 5.819435 -0.730546 -0.036192
C 3.543243 -1.429420 0.873257
C 2.297930 0.326415 -0.951059
C 1.525275 -0.447880 -0.061662
C 2.142534 -1.336999 0.865107
C 6.507733 0.060106 -0.938003
C 6.559510 -1.650758 0.909044
C 5.864520 0.969444 -1.879920
C -2.219086 -0.430084 0.123593
C -0.885120 -0.870581 0.568680
C -3.355300 -0.975097 0.784818
C -2.422901 0.494164 -0.942231
C -4.868292 0.351969 -0.643815
C -4.653545 -0.595566 0.415129
C -3.718357 0.869958 -1.320135
C -7.177909 0.988209 -0.345860
H 4.016414 -2.113928 1.584347
H 1.818687 1.005871 -1.659180
H 1.531677 -1.925752 1.548088
H 7.599840 0.040544 -0.989664
H 7.649024 -1.578444 0.762237
H 6.261003 -2.704621 0.753979
H 6.337454 -1.401919 1.963760
H -3.192006 -1.705756 1.584634
H -1.554944 0.906635 -1.463053
H -5.516091 -1.064797 0.902742
H -3.884268 1.569964 -2.144585
H -8.428282 1.034101 -1.975011
H -9.259621 1.381231 -0.463552
H -7.970800 1.490683 1.554458
H -6.267079 1.109004 1.523006


