%chk=000065772.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065772

0 1
 O   -3.575700      -2.412200      -1.251500    
 O   -4.194900      -2.173000       1.445000    
 O    4.013100       1.332700      0.4345000    
 O    1.581500      -2.735500     -0.2545000    
 O    3.762300      -1.400800      0.8089000    
 N  -0.6467000       2.913300     -0.2690000    
 C   -1.269000       1.946400      -1.194800    
 C   -2.030400      0.8307000     -0.4902000    
 C  -0.1504000       1.432500      -2.110600    
 C   -2.387000      0.9622000      0.8676000    
 C   -1.968100       2.175900       1.657000    
 C   -1.597300       3.347200      0.7517000    
 C   0.8904000      0.6792000      -1.333700    
 C   -2.460700     -0.3088000      -1.189200    
 C   -3.101300     -6.0500000E-02   1.509300    
 C   -3.182100      -1.315700     -0.5449000    
 C   -3.496300      -1.195000      0.8047000    
 C   0.7531000     -0.6915000      -1.151600    
 C    1.980300       1.360400     -0.8046000    
 C    2.947000      0.6604000     -8.2699999E-02
 C    1.719600      -1.391700     -0.4296000    
 C    2.816800     -0.7159000      0.1047000    
 C    3.869500       1.859900       1.751900    
 C   0.8662000      -3.168400      0.9011000    
 C    4.860200      -1.932000      7.0600003E-02
 H   -1.998100       2.487000      -1.813900    
 H   0.3237000       2.274200      -2.635500    
 H  -0.5442000      0.8004000      -2.915900    
 H   -2.780300       2.487900       2.324200    
 H   -1.107800       1.900400       2.280200    
 H   -2.490700       3.778500      0.2825000    
 H   -1.141800       4.137900       1.358000    
 H  -0.3202000       3.722200     -0.7975000    
 H   -2.260000     -0.4149000      -2.252200    
 H   -3.354100      3.3300001E-02   2.563000    
 H  -6.2100001E-02  -1.246600      -1.601500    
 H    2.096000       2.430600     -0.9554000    
 H   -4.327100      -2.836000     -0.8063000    
 H   -4.096900      -3.011600      0.9660000    
 H    3.683900       1.055600       2.470700    
 H    3.054400       2.589800       1.785900    
 H    4.801500       2.363200       2.023100    
 H    1.364600      -2.826400       1.813500    
 H   0.8458000      -4.261600      0.9020000    
 H  -0.1639000      -2.798800      0.8746000    
 H    4.510400      -2.652000     -0.6760000    
 H    5.524500      -2.448200      0.7690000    
 H    5.421600      -1.128700     -0.4168000    


%chk=000065772-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065772

0 1
O -3.607381 -2.336182 0.223704
O -4.146714 -1.174340 2.611009
O 2.971041 1.153585 1.493744
O 2.460865 -2.857825 -1.369833
O 3.797989 -1.534020 0.833336
N -0.931909 3.191836 -0.943428
C -1.466880 1.915413 -1.473620
C -2.146350 1.107197 -0.360190
C -0.334962 1.146078 -2.224734
C -2.454069 1.685050 0.902310
C -2.077487 3.128220 1.213697
C -1.875912 3.934254 -0.081867
C 0.716112 0.440098 -1.376021
C -2.532975 -0.233991 -0.616547
C -3.122867 0.911224 1.884950
C -3.186681 -0.989298 0.367571
C -3.487040 -0.419998 1.631878
C 1.091583 -0.887025 -1.697966
C 1.339267 1.078577 -0.276168
C 2.338455 0.417679 0.470724
C 2.086708 -1.555873 -0.954962
C 2.746448 -0.900085 0.119729
C 2.986047 0.533222 2.836750
C 2.301655 -3.914363 -0.344748
C 5.058021 -1.618206 0.054849
H -2.256332 2.115810 -2.248621
H 0.158409 1.884760 -2.892724
H -0.804960 0.407509 -2.901549
H -2.858684 3.599305 1.840383
H -1.131964 3.151426 1.790550
H -2.866920 4.100062 -0.573588
H -1.442843 4.925013 0.144989
H -0.534424 3.768321 -1.696381
H -2.307949 -0.692629 -1.587942
H -3.370692 1.342115 2.860702
H 0.624446 -1.425428 -2.530079
H 1.039937 2.092306 0.004680
H -3.344279 -2.708801 -0.651092
H -4.321195 -2.081450 2.245641
H 3.497166 -0.443737 2.813031
H 1.950885 0.414083 3.211449
H 3.534385 1.243351 3.474875
H 2.902852 -3.687280 0.553162
H 2.653952 -4.840664 -0.824411
H 1.235112 -4.016214 -0.065762
H 4.898133 -2.196850 -0.873154
H 5.777979 -2.133289 0.709772
H 5.423324 -0.602944 -0.186298


