%chk=000145722.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145722

0 1
 O    3.399400      0.1979000      9.8399997E-02
 O   -1.278000       2.010000     -0.4287000    
 O   -5.666400       1.486900     -0.4250000    
 O    6.837400      0.8371000      6.4499997E-02
 O    5.120500       2.116700      0.5484000    
 N   -2.767900      -1.454300      0.4834000    
 N   -4.948100     -0.6447000      0.1888000    
 N   -1.418300      -1.380700      0.5062000    
 N   -3.191900      0.7856000     -0.1500000    
 N    5.587100      0.9948000      0.1910000    
 C    2.750800     -0.9474000     -0.1948000    
 C  -0.9194000     -0.2220000      0.2016000    
 C    1.321200      -1.034500     -0.1284000    
 C   0.5371000     -1.3000000E-03  0.1860000    
 C    3.612000      -1.946100     -0.5416000    
 C   -3.595800     -0.4060000      0.1668000    
 C    4.721400     -7.0299998E-02 -6.4499997E-02
 C    4.904500      -1.375600     -0.4577000    
 C   -1.823600      0.9483000     -0.1513000    
 C   -5.890700      0.3212000     -0.1095000    
 C   -7.291200     -0.2158000      1.6400000E-02
 H   0.8912000      -2.005700     -0.3613000    
 H   0.9195000      0.9903000      0.3963000    
 H    3.362700      -2.960100     -0.8219000    
 H    5.848500      -1.861600     -0.6602000    
 H   -3.175000      -2.354600      0.7191000    
 H   -5.259200      -1.579100      0.4401000    
 H   -8.006200      0.5349000     -0.3315000    
 H   -7.502200     -0.4521000       1.063200    
 H   -7.405100      -1.117500     -0.5921000    


%chk=000145722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145722

0 1
O 3.440235 0.058348 0.233539
O -0.975111 1.980317 1.746420
O -5.392016 -1.755045 -0.967632
O 7.014510 0.302701 0.357701
O 5.388138 1.595183 1.352559
N -2.978121 -0.847541 -0.332923
N -5.053274 0.089141 0.414598
N -1.603943 -0.904047 -0.401370
N -3.043452 1.068131 1.108208
N 5.776000 0.611814 0.609965
C 2.705948 -0.916771 -0.485335
C -0.932455 0.035602 0.291777
C 1.272144 -0.885366 -0.438424
C 0.524579 0.031821 0.263475
C 3.607974 -1.774984 -1.142327
C -3.641572 0.115590 0.404816
C 4.786633 -0.228063 -0.002203
C 4.932120 -1.336219 -0.834285
C -1.622192 1.107714 1.107801
C -5.878187 -0.820786 -0.254193
C -7.369527 -0.621524 -0.075127
H 0.760439 -1.664732 -1.015768
H 1.002089 0.824256 0.850897
H 3.329266 -2.619093 -1.769966
H 5.877693 -1.757416 -1.164449
H -3.531375 -1.551959 -0.851615
H -5.455752 0.837977 0.986538
H -7.807864 -1.543223 0.344413
H -7.832945 -0.465136 -1.064412
H -7.625682 0.227610 0.579022


