%chk=000052604.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052604

0 1
 O   -4.766100       2.604200      0.3112000    
 N    3.555600     -0.1358000      0.2506000    
 N    8.106800      -2.834900      0.4570000    
 N    9.573200      -1.219300     -0.1524000    
 N   -7.476500      -3.067900      -1.085400    
 N   -8.700700      -2.427600      0.7100000    
 C    4.915200     -2.6100000E-02  6.3600004E-02
 C    5.171800       1.290700     -0.3244000    
 C    7.239600     -0.5786000     -5.5199999E-02
 C    8.323000      -1.540000      8.0300003E-02
 C    5.927000     -0.9822000      0.2066000    
 C    2.945600       1.062900     -5.2000000E-03
 C    9.341300      -3.559200      0.5025000    
 C    3.920000       1.966100     -0.3632000    
 C    6.502700       1.674300     -0.5829000    
 C    10.34210      -2.471600      0.1027000    
 C    7.525100      0.7288000     -0.4439000    
 C   -8.370400      -4.179400     -0.9575000    
 C   -7.723900      -2.137600     -0.1163000    
 C    1.551500       1.140900      0.1359000    
 C   -9.211300      -3.750800      0.2482000    
 C   -6.956700     -0.9071000     -5.7000001E-03
 C   0.8100000       2.249000     -0.1353000    
 C  -0.6567000       2.342300     -1.7700000E-02
 C   -7.250600      9.7000003E-03   1.003600    
 C   -5.926400     -0.6438000     -0.9084000    
 C   -5.496700       1.432600      0.2056000    
 C   -6.514400       1.189600       1.110300    
 C   -5.190100      0.5361000     -0.8019000    
 C   -3.412200       2.517500      0.2020000    
 C   -1.333100       1.425900      0.7701000    
 C   -1.328300       3.344400     -0.6980000    
 C   -2.720800       1.514200      0.8808000    
 C   -2.715900       3.432700     -0.5874000    
 H    5.662600      -1.987800      0.5107000    
 H    9.343400      -4.389000     -0.2103000    
 H    9.543800      -3.943700       1.506300    
 H    3.086400     -0.9849000      0.5360000    
 H    3.763100       3.003700     -0.6266000    
 H    6.739000       2.690100     -0.8867000    
 H    11.07050      -2.295800      0.9015000    
 H    10.88970      -2.755500     -0.8023000    
 H    8.543300       1.050400     -0.6495000    
 H    7.221400      -3.272200      0.6766000    
 H   -7.827000      -5.107700     -0.7588000    
 H   -8.985300      -4.304500      -1.853400    
 H   -10.26820      -3.658900     -2.3499999E-02
 H   -9.130000      -4.478800       1.062300    
 H    1.050200      0.2299000      0.4519000    
 H   -6.769600      -3.029200      -1.808100    
 H    1.303700       3.153900     -0.4838000    
 H   -8.046900     -0.1678000       1.721400    
 H   -5.665700      -1.324700      -1.712100    
 H   -6.743700       1.902500       1.896600    
 H   -4.408900      0.7293000      -1.531200    
 H  -0.8350000      0.6473000       1.338700    
 H  -0.8002000       4.063900      -1.318100    
 H   -3.234300      0.8056000       1.525600    
 H   -3.249300       4.216200      -1.118800    


%chk=000052604-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052604

0 1
O -4.691403 2.147844 0.377193
N 4.068730 -0.336747 0.405976
N 9.008590 -2.541365 0.480318
N 10.268983 -0.634389 0.148198
N -8.699274 -2.862987 -1.160616
N -9.676007 -2.021236 0.752530
C 5.416997 -0.096012 0.134548
C 5.499267 1.211073 -0.475107
C 7.814781 -0.379622 -0.011640
C 9.054178 -1.160108 0.191313
C 6.552483 -0.896141 0.371193
C 3.286789 0.765666 -0.010229
C 10.391981 -3.079165 0.470154
C 4.161090 1.728199 -0.557019
C 6.782533 1.710068 -0.841922
C 11.231355 -1.747277 0.439285
C 7.915912 0.921204 -0.608462
C -9.963424 -3.637325 -1.093111
C -8.685723 -1.915690 -0.119409
C 1.847124 0.748573 0.165363
C -10.519344 -3.179866 0.307637
C -7.612210 -0.903043 -0.010782
C 0.993036 1.764881 -0.191812
C -0.464208 1.791947 -0.035867
C -7.781486 0.186692 0.885684
C -6.417569 -0.982647 -0.772921
C -5.603350 1.071993 0.249097
C -6.787067 1.170680 1.017140
C -5.411959 -0.000630 -0.651958
C -3.298940 1.955235 0.204875
C -1.220238 0.726969 0.541796
C -1.182489 2.944301 -0.474252
C -2.618193 0.800394 0.665670
C -2.581861 3.032404 -0.358616
H 6.467590 -1.866143 0.874048
H 10.574915 -3.703088 -0.428697
H 10.599604 -3.687871 1.367673
H 3.694825 -1.175850 0.844582
H 3.864352 2.692848 -0.965276
H 6.882178 2.699923 -1.299880
H 11.709906 -1.554159 1.418429
H 12.029580 -1.765618 -0.323495
H 8.918164 1.273458 -0.869828
H 8.219197 -3.121566 0.196888
H -9.777934 -4.724831 -1.139268
H -10.648392 -3.361642 -1.920632
H -11.580638 -2.878593 0.264583
H -10.432058 -3.989305 1.057090
H 1.431677 -0.161570 0.622524
H -8.209226 -2.719274 -2.042466
H 1.431987 2.664603 -0.645911
H -8.703370 0.231468 1.473229
H -6.247161 -1.826060 -1.451664
H -6.905543 2.016457 1.700577
H -4.499737 -0.065104 -1.252632
H -0.711439 -0.169922 0.911380
H -0.628137 3.781254 -0.915567
H -3.177317 -0.019220 1.127901
H -3.129405 3.918234 -0.693239


