%chk=000142699.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142699

0 1
 O    3.163100      -1.328400      0.1021000    
 O   -8.413100       1.109900     -0.3463000    
 N   -3.156200     -0.3974000      0.5957000    
 C    6.421300      0.4808000     -0.3745000    
 C    7.776000      0.4583000      0.3391000    
 C    5.395500     -0.4707000      0.2391000    
 C    8.794800       1.428800     -0.2598000    
 C    4.077200     -0.4378000     -0.5227000    
 C    10.14280       1.316300      0.4362000    
 C    1.831300      -1.020000      9.9999997E-05
 C    1.368200     -0.3331000      -1.116000    
 C   0.9581000      -1.398800       1.013100    
 C  -0.8697000     -0.3968000     -0.2084000    
 C   1.2900000E-02 -2.0300001E-02  -1.220500    
 C  -0.3972000      -1.086100      0.9084000    
 C   -2.283000     -7.1000002E-02 -0.3174000    
 C   -4.487900     -1.6600000E-02  0.3582000    
 C   -5.341600     -0.8780000     -0.3237000    
 C   -4.942300       1.220200      0.8052000    
 C   -6.662900     -0.4988000     -0.5610000    
 C   -6.263500       1.599600      0.5681000    
 C   -7.123900      0.7399000     -0.1151000    
 H    6.570600      0.2211000      -1.429900    
 H    6.023700       1.503200     -0.3536000    
 H    7.628400      0.6994000       1.399200    
 H    8.179800     -0.5612000      0.3003000    
 H    5.218600     -0.2092000       1.289800    
 H    5.786300      -1.495700      0.2463000    
 H    8.424100       2.456500     -0.1724000    
 H    8.923600       1.219200      -1.328000    
 H    4.234900     -0.7546000      -1.560300    
 H    3.709200      0.5965000     -0.5087000    
 H    10.55420      0.3069000      0.3348000    
 H    10.05370       1.546100       1.502700    
 H    10.85630       2.019500     -4.6000001E-03
 H    2.016400     -4.7499999E-02  -1.938800    
 H    1.322600      -1.935700       1.884200    
 H  -0.3419000      0.5116000      -2.099600    
 H   -1.061400      -1.392100       1.712200    
 H   -2.600200      0.4776000      -1.224400    
 H   -4.990900      -1.844900     -0.6742000    
 H   -4.278700       1.895800       1.338500    
 H   -7.328300      -1.172700      -1.093600    
 H   -6.610200       2.567200      0.9208000    
 H   -8.559300       1.994700      3.0300001E-02


%chk=000142699-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142699

0 1
O 3.132783 0.041109 0.886770
O -8.900695 -0.047833 -0.628096
N -3.348652 0.052494 0.499952
C 6.708412 0.386659 -0.405110
C 8.084961 0.225075 0.278446
C 5.528766 0.139655 0.563634
C 9.272844 0.470811 -0.679671
C 4.174423 0.298596 -0.129075
C 10.644067 0.304801 0.010268
C 1.793447 0.117561 0.492501
C 1.356888 0.431615 -0.820497
C 0.841848 -0.147476 1.516714
C -0.988815 0.213218 -0.083784
C -0.025842 0.476187 -1.093421
C -0.527533 -0.100824 1.230590
C -2.419682 0.265839 -0.404174
C -4.727729 0.032462 0.164784
C -5.246473 -0.355735 -1.108644
C -5.649539 0.367857 1.193597
C -6.631655 -0.378395 -1.348334
C -7.037393 0.365700 0.956637
C -7.528606 -0.006064 -0.319421
H 6.642484 -0.317304 -1.261201
H 6.632221 1.408193 -0.833313
H 8.154478 0.927220 1.135210
H 8.165096 -0.795998 0.706036
H 5.582298 0.847058 1.413217
H 5.595846 -0.879820 0.989344
H 9.192558 1.491982 -1.105379
H 9.200842 -0.229896 -1.536589
H 4.064942 -0.427095 -0.962073
H 4.050538 1.325284 -0.532845
H 10.762765 -0.718005 0.415101
H 10.751248 1.012878 0.853666
H 11.476829 0.488515 -0.693110
H 2.072812 0.638561 -1.620819
H 1.210394 -0.386398 2.519060
H -0.364058 0.719663 -2.108797
H -1.275414 -0.302937 2.003697
H -2.664348 0.521530 -1.458417
H -4.562896 -0.676662 -1.903146
H -5.248132 0.637563 2.175258
H -7.038677 -0.691097 -2.314652
H -7.731825 0.640959 1.761252
H -9.444425 0.214194 0.155734


