%chk=000131962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131962

0 1
 O    1.307200     -0.6432000     -0.3452000    
 O    1.449700      -2.939700     -0.2708000    
 O   -2.761800      -2.617800      9.1600001E-02
 N   -1.297200      0.5540000     -0.1571000    
 N   -3.898800     -0.5016000      0.1131000    
 C    3.207100      0.9370000     -0.4974000    
 C    4.701000      0.7967000     -7.4299999E-02
 C    4.301000      6.7000002E-02   1.236000    
 C    2.714500     -0.5417000     -0.4757000    
 C    2.572700       1.667000      0.7202000    
 C    3.445600      -1.126700      0.7470000    
 C    3.323500       1.053000       1.914000    
 C    2.923000       1.641000      -1.810900    
 C    5.453900       2.123900      0.1496000    
 C    5.586200     -4.2500000E-02  -1.017300    
 C   0.8001000      -1.905700     -0.2516000    
 C  -0.6786000      -1.875300     -0.1212000    
 C   -1.496000     -0.7782000     -8.9500003E-02
 C   -1.447900      -2.982300     -1.1000000E-02
 C   -2.774700      -1.261000      4.2300001E-02
 C   -1.184000      -4.429900      1.9800000E-02
 C   -2.407000       1.450100     -9.2299998E-02
 C   -3.736600      0.9123000      4.5699999E-02
 C   -5.218500      -1.093400      0.2524000    
 C   -2.201800       2.832100     -0.1620000    
 C   -4.807700       1.814100      0.1071000    
 C   -3.290800       3.698100     -9.7900003E-02
 C   -4.583900       3.192700      3.5399999E-02
 H    5.129200     -0.2326000       1.882500    
 H    3.009600      -1.059600      -1.396800    
 H    1.493600       1.515300      0.8071000    
 H    2.733900       2.750100      0.6786000    
 H    4.090800      -1.959700      0.4472000    
 H    2.779500      -1.491100       1.536000    
 H    3.858200       1.825200       2.477000    
 H    2.640300      0.5549000       2.610100    
 H    3.304600       2.667100      -1.804200    
 H    3.387600       1.116900      -2.652200    
 H    1.845500       1.688800      -2.002700    
 H    4.932300       2.841900      0.7856000    
 H    6.425700       1.934900      0.6204000    
 H    5.639800       2.628100     -0.8056000    
 H    5.749700      0.4846000      -1.964100    
 H    6.567500     -0.2178000     -0.5609000    
 H    5.182000      -1.024600      -1.270200    
 H  -0.3830000      0.9765000     -0.2718000    
 H  -0.6942000      -4.752100     -0.9043000    
 H  -0.5350000      -4.685400      0.8632000    
 H   -2.110400      -5.003700      0.1249000    
 H   -5.185000      -2.188100      0.2904000    
 H   -5.856200     -0.8245000     -0.5972000    
 H   -5.698400     -0.7583000       1.178900    
 H   -1.199400       3.238800     -0.2657000    
 H   -5.832800       1.469500      0.2108000    
 H   -3.132900       4.771500     -0.1519000    
 H   -5.426700       3.877100      8.4399998E-02


%chk=000131962-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000131962

0 1
O 1.314470 -0.697194 -0.105605
O 1.503785 -3.022072 -0.359530
O -2.861432 -2.668606 -0.119994
N -1.292346 0.572864 -0.005099
N -3.979508 -0.478499 0.028275
C 3.203080 0.886548 -0.485540
C 4.743895 0.817000 -0.088280
C 4.438682 0.268781 1.355734
C 2.798743 -0.595072 -0.232959
C 2.611330 1.741143 0.688739
C 3.571154 -0.995050 1.066152
C 3.484319 1.351755 1.935492
C 2.852357 1.401135 -1.884475
C 5.446160 2.195771 -0.114745
C 5.599653 -0.142044 -0.954970
C 0.780387 -2.002299 -0.219470
C -0.678706 -1.969238 -0.154978
C -1.536390 -0.807959 -0.060637
C -1.507714 -3.105803 -0.191014
C -2.833048 -1.274196 -0.042750
C -1.272226 -4.574454 -0.280380
C -2.396367 1.455979 0.061279
C -3.746991 0.937971 0.077504
C -5.326062 -1.045166 0.050538
C -2.196914 2.850906 0.113052
C -4.825623 1.844427 0.142982
C -3.293474 3.749653 0.179600
C -4.605442 3.248114 0.194305
H 5.326618 0.068282 1.979469
H 3.076168 -1.241875 -1.083514
H 1.543865 1.513404 0.850965
H 2.684321 2.818351 0.453481
H 4.171177 -1.905529 0.904321
H 2.869715 -1.206721 1.892242
H 4.044557 2.219676 2.326340
H 2.875845 0.952110 2.766060
H 3.189430 2.445249 -2.022455
H 3.320107 0.783829 -2.674769
H 1.759192 1.376667 -2.052133
H 4.881275 2.987770 0.403335
H 6.441340 2.125567 0.364066
H 5.605419 2.527112 -1.158325
H 5.609505 0.189160 -2.010793
H 6.647327 -0.133062 -0.599447
H 5.257212 -1.189788 -0.934573
H -0.330159 0.906551 -0.023506
H -0.718651 -4.838799 -1.200129
H -0.663090 -4.940002 0.567005
H -2.237527 -5.108146 -0.279722
H -5.251871 -2.142483 0.009910
H -5.922838 -0.702243 -0.818469
H -5.866189 -0.764008 0.976810
H -1.170436 3.237249 0.101322
H -5.851582 1.465643 0.154706
H -3.107793 4.828122 0.219032
H -5.462707 3.927220 0.245045


