%chk=000205797.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205797

0 1
O 1.530872 -0.979613 0.708922
O -4.194780 0.443830 -1.340802
O -4.837547 -0.612558 0.535137
N 4.900342 0.254052 0.018764
N -0.169321 0.205339 -0.394283
C 3.839840 -0.671538 0.523303
C 5.230255 1.304741 1.039989
C 6.124157 -0.485764 -0.433158
C 2.507370 -0.120961 -0.000460
C 5.892050 2.501751 0.356237
C 5.838851 -1.221527 -1.742788
C 0.217748 -0.778649 0.474557
C -2.045953 -1.435454 0.944856
C -2.480741 -0.421320 0.039183
C -0.682058 -1.618083 1.163150
C -1.503266 0.379476 -0.612122
C -3.021241 -2.304217 1.653258
C -1.848357 1.465200 -1.569333
C -3.919070 -0.236798 -0.166720
C -5.599128 0.704787 -1.654839
C -6.088526 1.899566 -0.862120
H 3.805628 -0.765749 1.630283
H 3.988512 -1.705465 0.141368
H 4.282103 1.639699 1.517903
H 5.879032 0.921892 1.857114
H 6.506742 -1.194801 0.332156
H 6.931121 0.263108 -0.605258
H 2.314982 0.927705 0.276803
H 2.371725 -0.255045 -1.085376
H 6.892125 2.260132 -0.020970
H 5.298802 2.836298 -0.506489
H 5.987040 3.345763 1.046873
H 5.136094 -2.051229 -1.606980
H 5.391591 -0.542866 -2.482535
H 6.759246 -1.628441 -2.173577
H -0.301441 -2.377598 1.839247
H -3.752508 -1.699973 2.226589
H -3.637394 -2.883933 0.945298
H -2.555655 -3.012618 2.348220
H -2.594832 2.157108 -1.146693
H -0.970407 2.053207 -1.878747
H -2.309766 1.045208 -2.481713
H -5.536889 0.896112 -2.741053
H -6.185262 -0.208877 -1.448044
H -5.424965 2.764490 -0.980434
H -6.131109 1.666555 0.213143
H -7.095210 2.202060 -1.172458


%chk=000205797-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205797

0 1
O 1.532291 -1.132186 0.737165
O -4.266714 0.323758 -1.356390
O -4.872738 -0.390273 0.773566
N 4.947530 0.200924 0.003872
N -0.173157 0.195640 -0.215981
C 3.899082 -0.708526 0.529072
C 5.194684 1.366737 0.895948
C 6.191675 -0.503045 -0.404778
C 2.514055 -0.213675 0.094456
C 5.739227 2.596367 0.144525
C 6.035073 -1.275452 -1.728585
C 0.189216 -0.873149 0.531333
C -2.112299 -1.538467 0.940078
C -2.514150 -0.422945 0.118651
C -0.737457 -1.758357 1.132767
C -1.505284 0.431136 -0.431104
C -3.103240 -2.490534 1.579327
C -1.788524 1.670036 -1.257331
C -3.970164 -0.168162 -0.076762
C -5.703926 0.638696 -1.625154
C -6.061773 2.044074 -1.131123
H 3.928888 -0.798805 1.640582
H 4.054688 -1.723354 0.123637
H 4.231377 1.640558 1.365500
H 5.886217 1.097184 1.734592
H 6.551903 -1.195415 0.398294
H 6.980103 0.260154 -0.535829
H 2.311602 0.820740 0.424852
H 2.396697 -0.253047 -1.001873
H 6.717565 2.392800 -0.327514
H 5.034857 2.896848 -0.650525
H 5.874862 3.445436 0.840417
H 5.266517 -2.066836 -1.656667
H 5.737081 -0.584736 -2.536474
H 6.988752 -1.761058 -2.008455
H -0.373486 -2.597144 1.731079
H -3.700425 -1.976315 2.351370
H -3.830960 -2.878008 0.844221
H -2.576130 -3.344269 2.037324
H -2.580410 2.295419 -0.810851
H -0.857111 2.251147 -1.339653
H -2.136148 1.396082 -2.268294
H -5.783852 0.551379 -2.720582
H -6.329422 -0.127233 -1.133986
H -5.401463 2.803616 -1.584820
H -5.979583 2.104566 -0.033025
H -7.104722 2.282694 -1.411471


