%chk=000144766.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144766

0 1
 O   -3.832100     -0.3929000     -0.5003000    
 O   -3.798500      -2.283000      0.8762000    
 O    8.497100       1.374700     -0.4869000    
 N    1.674800      5.7100002E-02  0.3131000    
 N    2.277200     -8.6000003E-03 -0.7843000    
 C   -8.065900     -0.2146000     -0.1089000    
 C   -8.748800       1.086800      0.3164000    
 C   -6.578000     -0.2056000      0.2558000    
 C   -10.23950       1.068000     -2.0700000E-02
 C   -5.874700      -1.506000     -0.1319000    
 C   -10.91550       2.372400      0.3704000    
 C   -4.389200      -1.486400      0.1593000    
 C   -2.454700     -0.2805000     -0.2971000    
 C    6.413900      0.3289000     -0.1743000    
 C   -1.567000     -0.9126000      -1.167900    
 C   -1.967000      0.4642000      0.7768000    
 C    8.581800     -0.5821000      0.9160000    
 C    7.847900      0.4462000      3.6800001E-02
 C   0.2961000     -5.5100001E-02  0.1091000    
 C  -0.1917000     -0.7998000     -0.9648000    
 C  -0.5917000      0.5769000      0.9799000    
 C    5.807000     -0.9269000     -0.1594000    
 C    5.645200       1.472400     -0.3918000    
 C    3.663000      0.1042000     -0.5798000    
 C    4.431600      -1.039300     -0.3622000    
 C    4.269900       1.360100     -0.5946000    
 C    9.808800     -1.8200001E-02   1.615200    
 H   -8.177800     -0.3547000      -1.190800    
 H   -8.556100      -1.064600      0.3808000    
 H   -8.619300       1.236000       1.395300    
 H   -8.267700       1.934200     -0.1870000    
 H   -6.459500     -4.0899999E-02   1.334100    
 H   -6.098300      0.6466000     -0.2409000    
 H   -10.37630      0.9017000      -1.095500    
 H   -10.72890      0.2374000      0.5011000    
 H   -6.314200      -2.343800      0.4220000    
 H   -6.004600      -1.721300      -1.198700    
 H   -10.47070       3.219700     -0.1611000    
 H   -11.98070       2.336700      0.1215000    
 H   -10.82380       2.554500       1.445900    
 H   -1.941700      -1.497400      -2.003600    
 H   -2.653800      0.9592000       1.457900    
 H    8.873100      -1.423800      0.2784000    
 H    7.894300     -0.9493000       1.686000    
 H   0.4634000      -1.326100      -1.654500    
 H  -0.2206000       1.159100       1.819300    
 H    6.382200      -1.835800     -7.1000000E-03
 H    6.099500       2.459800     -0.4026000    
 H    3.968000      -2.022400     -0.3528000    
 H    3.679100       2.256700     -0.7632000    
 H    10.55860      0.3099000      0.8880000    
 H    9.542400      0.8452000       2.233500    
 H    10.26550     -0.7771000       2.257800    


%chk=000144766-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000144766

0 1
O -3.937845 -1.189029 -0.547095
O -4.571540 -2.883743 0.969979
O 8.556001 1.633372 -0.610299
N 1.650344 -0.738966 0.213510
N 2.277838 0.129369 -0.542551
C -8.208729 -0.010876 -0.244677
C -8.725453 1.322111 0.341678
C -6.779500 -0.354596 0.230926
C -10.153664 1.681697 -0.129481
C -6.266815 -1.691390 -0.379201
C -10.659318 3.017697 0.456037
C -4.875900 -2.033979 0.110630
C -2.539599 -1.152965 -0.295262
C 6.487996 0.571543 0.014394
C -1.855722 -0.214217 -1.112710
C -1.846751 -1.937838 0.659642
C 8.750724 0.006715 1.196708
C 7.970830 0.799420 0.142313
C 0.244789 -0.822509 -0.021779
C -0.472219 -0.046482 -0.980735
C -0.454367 -1.758462 0.783636
C 5.778582 -0.357704 0.830553
C 5.771197 1.318389 -0.960585
C 3.686046 0.216651 -0.297551
C 4.394675 -0.538118 0.681286
C 4.386329 1.144718 -1.115632
C 10.249604 0.348797 1.227164
H -8.225011 0.044463 -1.353140
H -8.901153 -0.830291 0.039389
H -8.709607 1.268000 1.450154
H -8.031554 2.141449 0.060089
H -6.764451 -0.427019 1.336338
H -6.085567 0.460115 -0.051208
H -10.170116 1.732061 -1.237410
H -10.848059 0.865022 0.155307
H -6.936801 -2.519688 -0.091790
H -6.255875 -1.605541 -1.480883
H -10.001368 3.855694 0.157865
H -11.682125 3.250904 0.107607
H -10.678316 2.984110 1.561719
H -2.435447 0.366511 -1.836449
H -2.378232 -2.659882 1.278851
H 8.603176 -1.075475 1.000176
H 8.289338 0.194285 2.188208
H 0.076904 0.670979 -1.596956
H 0.117810 -2.343197 1.511073
H 6.312291 -0.942415 1.587105
H 6.330545 2.027461 -1.579234
H 3.838243 -1.247000 1.301291
H 3.817019 1.711401 -1.859348
H 10.720224 0.146975 0.249964
H 10.405117 1.419126 1.445167
H 10.767581 -0.247856 1.999119


