%chk=000196857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196857

0 1
O 2.027793 0.520434 1.402852
O 0.901906 -2.160254 -0.375908
O 3.385843 1.636771 -1.763501
O -3.168097 -0.423232 -1.800533
N -0.083296 -0.467547 0.812721
N -1.151018 -1.327436 -1.200731
C 1.875501 -1.764777 0.663050
C 1.207595 -0.633458 1.518363
C 3.067633 -1.099813 -0.023278
C 2.931522 0.405727 0.257721
C -0.183381 -1.317735 -0.335490
C 2.328564 1.227034 -0.894748
C -1.066799 0.529441 0.977535
C -2.116009 0.569547 0.116083
C -2.243884 -0.385175 -1.027217
C -3.199986 1.599005 0.251815
C -2.737405 2.975615 -0.222675
H 2.091100 -2.708630 1.192382
H 1.075570 -0.795061 2.607632
H 4.025586 -1.495450 0.363318
H 3.067626 -1.329628 -1.108867
H 3.870684 0.874749 0.625916
H 1.916266 2.184390 -0.511252
H 1.541318 0.692171 -1.451289
H -0.929947 1.220257 1.814197
H -4.087924 1.280875 -0.344863
H -3.551817 1.651500 1.302015
H 3.600320 0.926910 -2.403784
H -3.548468 3.709699 -0.148199
H -2.422855 2.947107 -1.274241
H -1.893542 3.351964 0.364075


%chk=000196857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196857

0 1
O 2.121973 0.497957 1.467372
O 0.999024 -1.844756 -0.711574
O 3.728037 1.166503 -1.897369
O -3.178421 0.027855 -1.894237
N -0.051433 -0.378622 0.698301
N -1.098034 -0.951272 -1.400778
C 1.868861 -1.730657 0.506527
C 1.205268 -0.638009 1.414839
C 3.251453 -1.159355 0.147629
C 3.115906 0.368383 0.348891
C -0.135359 -1.040921 -0.529813
C 2.655779 1.168700 -0.891744
C -1.085733 0.499911 1.047908
C -2.155912 0.671672 0.200821
C -2.206764 -0.082741 -1.094599
C -3.292583 1.620294 0.514498
C -3.253421 2.902722 -0.359306
H 1.900379 -2.730733 0.963071
H 1.011822 -0.929698 2.459523
H 4.004526 -1.568801 0.843104
H 3.542832 -1.440640 -0.877133
H 4.045381 0.821881 0.728897
H 2.508902 2.221123 -0.599157
H 1.705925 0.781998 -1.307655
H -0.975526 1.025323 1.999889
H -4.247080 1.096534 0.318779
H -3.270576 1.894142 1.586858
H 3.563190 0.457812 -2.566504
H -4.110209 3.557269 -0.117726
H -3.314561 2.636430 -1.427627
H -2.323245 3.474697 -0.188586


