%chk=000103254.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103254

0 1
 O    1.019900      -1.576200      2.3000001E-03
 O   -3.718000      0.8934000     -4.1000000E-03
 O    2.833900      0.5106000       2.329500    
 O    2.804300      0.4370000      -2.331500    
 O   -3.182400       3.581200      -1.100800    
 O   -3.179900       3.583900       1.094500    
 O   -5.584600      -1.114300       1.102000    
 O   -5.587100      -1.115800      -1.093200    
 N    2.349500      0.6792000     -1.2000001E-03
 N   -2.666200       3.268500     -3.4000000E-03
 N   -5.029800      -1.348900      3.8999999E-03
 C  -0.1385000      0.4912000     -1.7000000E-03
 C    1.036100       1.253300     -2.0000001E-03
 C   -1.381500       1.127600     -2.4999999E-03
 C   -2.541800      -1.138800      1.2000001E-03
 C   -1.298700      -1.775200      1.8000000E-03
 C  -5.1600002E-02 -0.9834000      3.0000001E-04
 C   -2.628500      0.3359000     -1.4000000E-03
 C   -1.450100       2.526100     -3.8999999E-03
 C   0.9631000       2.646600     -3.0000000E-03
 C    4.341800     -0.1958000      0.6902000    
 C    4.345400     -0.1891000     -0.6905000    
 C    3.071800      0.3641000       1.144200    
 C    3.072300      0.3625000      -1.145900    
 C  -0.2773000       3.281600     -4.0000002E-03
 C   -3.716200      -1.900700      2.9000000E-03
 C   -1.230200      -3.173600      3.7000000E-03
 C    5.415000     -0.6665000       1.420800    
 C    5.420600     -0.6571000      -1.420000    
 C   -3.643400      -3.293900      4.9000001E-03
 C   -2.403000      -3.929000      5.2000000E-03
 C    6.516100      -1.144500      0.7052000    
 C    6.518800      -1.140100     -0.7033000    
 H    1.867200       3.250700     -3.1000001E-03
 H  -0.3103000       4.368900     -4.6000001E-03
 H  -0.2766000      -3.694800      4.1000000E-03
 H    5.413500     -0.6692000       2.504500    
 H    5.422500     -0.6547000      -2.503800    
 H   -4.544700      -3.903000      6.3000000E-03
 H   -2.349000      -5.013800      6.8999999E-03
 H    7.382300      -1.524700       1.240300    
 H    7.386800      -1.517700      -1.237400    


%chk=000103254-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103254

0 1
O 0.974435 -1.632834 -0.755391
O -3.723525 0.792931 -0.840373
O 2.002050 -0.649027 1.786847
O 3.415508 1.838805 -1.976113
O -2.985804 4.190877 -1.013926
O -3.444907 3.051461 0.917029
O -5.065337 -0.314680 1.467243
O -6.065739 -1.867643 0.117702
N 2.352460 0.714433 -0.148876
N -2.739939 3.287891 -0.129614
N -5.036195 -1.305244 0.651230
C -0.129863 0.478173 -0.267748
C 1.053893 1.281608 -0.264641
C -1.407399 1.119040 -0.250259
C -2.576410 -1.132909 0.041454
C -1.323310 -1.789747 -0.091686
C -0.074551 -1.018866 -0.395393
C -2.668043 0.307895 -0.345538
C -1.461744 2.533328 -0.281182
C 0.956822 2.689459 -0.362441
C 4.163766 -0.573518 0.570480
C 4.588596 0.177492 -0.550849
C 2.739097 -0.247051 0.860944
C 3.456126 1.023264 -1.026896
C -0.299405 3.317471 -0.386449
C -3.708768 -1.921548 0.361535
C -1.226857 -3.195752 0.056042
C 5.031715 -1.454659 1.233335
C 5.894281 0.070651 -1.053627
C -3.627111 -3.319155 0.499088
C -2.375358 -3.957563 0.341645
C 6.353641 -1.571948 0.732428
C 6.778423 -0.821046 -0.394003
H 1.869962 3.287533 -0.399014
H -0.384815 4.405715 -0.447805
H -0.244822 -3.661677 -0.065690
H 4.692618 -2.029379 2.100483
H 6.210349 0.655997 -1.922447
H -4.531763 -3.888408 0.730965
H -2.304764 -5.043611 0.452513
H 7.059039 -2.252912 1.220054
H 7.805150 -0.933345 -0.757657


