%chk=000154720.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154720

0 1
 O   -5.270900     -0.2489000      3.0000000E-03
 O   -4.097100       1.606200      1.9000000E-03
 O    5.528700     -8.6599998E-02  1.1000000E-03
 O    4.389100      -1.963000      1.8000000E-03
 N   -4.176700      0.3577000      1.3000000E-03
 N    4.439600     -0.7094000      1.0000000E-03
 C  -0.5244000     -0.6004000     -1.1000000E-03
 C   0.7616000      4.7200002E-02 -8.9999998E-04
 C   -1.699800      0.1952000     -1.1000000E-03
 C   0.8231000       1.465400     -8.9999998E-04
 C   -1.598900       1.588700     -7.9999998E-04
 C  -0.3564000       2.214200     -1.0000000E-03
 C   -2.970200     -0.4058000     -7.9999998E-04
 C    1.999700     -0.6429000     -3.0000001E-04
 C  -0.7076000      -2.006100     -1.0000000E-03
 C    2.062800       2.127600     -5.0000002E-04
 C    3.225600      2.8000001E-02  3.9999999E-04
 C   -3.108600      -1.790200     -1.0000000E-03
 C    3.257100       1.413900       0.000000    
 C   -1.976900      -2.590900     -1.1000000E-03
 H   -2.350700       2.355100     -1.8000000E-03
 H  -0.3173000       3.302600     -1.1000000E-03
 H    1.997000      -1.729800     -1.9999999E-04
 H   0.1406000      -2.685600     -8.9999998E-04
 H    2.108400       3.215300     -3.9999999E-04
 H   -4.074100      -2.288800     -6.9999998E-04
 H    4.188300       1.973900      3.0000001E-04
 H   -2.074100      -3.672800     -1.0000000E-03


%chk=000154720-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154720

0 1
O -5.397387 -0.446575 -0.001400
O -4.380617 1.576544 -0.002638
O 5.590620 -0.174726 -0.001210
O 4.349622 -2.088286 -0.000950
N -4.332367 0.285238 0.000116
N 4.461972 -0.801082 0.000122
C -0.546151 -0.547062 0.000027
C 0.776098 0.092545 0.000010
C -1.742521 0.275165 0.000009
C 0.868932 1.530924 -0.000055
C -1.591028 1.716921 -0.000043
C -0.340795 2.307815 -0.000080
C -3.010813 -0.415089 0.000099
C 1.988375 -0.654354 0.000060
C -0.668837 -1.967646 0.000031
C 2.148718 2.170614 -0.000074
C 3.219837 0.011129 0.000045
C -3.098668 -1.817205 0.000101
C 3.328914 1.428196 -0.000039
C -1.920266 -2.595117 0.000070
H -2.489613 2.330857 -0.000064
H -0.260016 3.400588 -0.000135
H 2.008632 -1.745817 0.000145
H 0.226693 -2.593808 -0.000012
H 2.188803 3.265106 -0.000111
H -4.087869 -2.280065 0.000174
H 4.317955 1.891600 -0.000050
H -1.990320 -3.686612 0.000053


