%chk=000287277.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287277

0 1
O -2.761037 2.220981 -0.530980
O -5.311342 1.325318 -1.498343
O 4.639805 2.973380 0.917486
O 5.431324 1.842405 -1.158749
N -2.150825 -3.729617 0.836306
C -2.742558 -1.397241 0.354385
C -3.999381 -1.767910 -0.165927
C -1.915730 -2.462448 0.979743
C -4.466880 -3.190492 -0.041973
C -0.753253 -2.077495 1.870334
C -3.292097 -4.184329 0.027278
C 0.417753 -1.508150 1.117645
C -2.306151 -0.069475 0.237129
C -4.820775 -0.811136 -0.772269
C 1.053149 -0.366371 1.568692
C 2.167501 0.169398 0.862825
C -3.108222 0.883967 -0.386271
C -4.386471 0.516588 -0.889678
C 2.623534 -0.479171 -0.313565
C 0.888063 -2.166614 -0.054948
C 1.960917 -1.662585 -0.752201
C 2.832404 1.357831 1.322697
C 3.739945 0.060041 -1.039415
C 3.897341 1.857049 0.622510
C 4.361002 1.193600 -0.590767
C -1.349296 2.537977 -0.438640
C -4.966851 2.717953 -1.717911
C 4.303161 3.688514 2.132962
C 5.994606 1.255689 -2.358668
H -5.089082 -3.277184 0.876061
H -5.136217 -3.464389 -0.881127
H -0.401032 -2.978105 2.433697
H -1.119965 -1.375850 2.649504
H -3.634326 -5.147798 0.470358
H -2.922907 -4.421945 -0.997581
H -1.329490 0.216657 0.628745
H -5.800254 -1.076263 -1.168111
H 0.718875 0.137152 2.473059
H 0.383541 -3.076094 -0.384819
H 2.320245 -2.164145 -1.649943
H 2.472169 1.829346 2.231349
H 4.067162 -0.456446 -1.936850
H -0.768272 1.930029 -1.138901
H -1.001399 2.408073 0.590173
H -1.337932 3.595468 -0.727954
H -4.100629 2.788353 -2.383081
H -4.765596 3.210514 -0.759718
H -5.877742 3.102156 -2.189878
H 4.433711 3.041574 3.005112
H 3.288890 4.091314 2.069379
H 5.049281 4.494402 2.125442
H 6.813000 1.953892 -2.579321
H 5.254968 1.250345 -3.163972
H 6.379668 0.253784 -2.149010


%chk=000287277-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287277

0 1
O -2.860624 2.299396 -0.399973
O -5.472630 1.465377 -1.269415
O 4.796222 2.982851 0.998308
O 5.597460 1.838386 -1.224048
N -2.157368 -3.748430 0.796251
C -2.803561 -1.394434 0.383838
C -4.110273 -1.754812 -0.058544
C -1.937005 -2.459617 0.968932
C -4.546117 -3.198415 0.125388
C -0.724878 -2.090060 1.824884
C -3.329522 -4.135297 -0.041847
C 0.456813 -1.498150 1.054703
C -2.377853 -0.046082 0.265123
C -4.944253 -0.767363 -0.614876
C 1.130791 -0.361744 1.524061
C 2.256866 0.186429 0.829229
C -3.218248 0.941573 -0.289658
C -4.522220 0.574766 -0.752419
C 2.704017 -0.446989 -0.389539
C 0.915333 -2.124286 -0.150860
C 2.007742 -1.609803 -0.852631
C 2.956029 1.346224 1.305853
C 3.828497 0.102078 -1.091609
C 4.050871 1.865958 0.612383
C 4.495873 1.231666 -0.615171
C -1.534574 2.686259 0.092835
C -5.050911 2.462301 -2.275958
C 4.406116 3.645657 2.244176
C 6.092743 1.227220 -2.459000
H -4.963402 -3.330397 1.146208
H -5.345578 -3.469115 -0.588195
H -0.407856 -3.030840 2.312168
H -1.031412 -1.386556 2.622903
H -3.595473 -5.174421 0.219724
H -3.000615 -4.139334 -1.104142
H -1.372041 0.220923 0.596361
H -5.952371 -1.012453 -0.965658
H 0.799455 0.120597 2.454212
H 0.393432 -3.017741 -0.510527
H 2.348388 -2.099066 -1.773643
H 2.617575 1.814582 2.235662
H 4.156112 -0.388809 -2.013419
H -0.728224 2.160525 -0.453528
H -1.438265 2.483024 1.176983
H -1.465796 3.768732 -0.090485
H -4.586864 1.957939 -3.145262
H -4.344644 3.188476 -1.845194
H -5.985082 2.955851 -2.584672
H 4.488033 2.957100 3.107931
H 3.373286 4.041990 2.183283
H 5.117325 4.476195 2.360096
H 6.948750 1.847735 -2.761122
H 5.319731 1.241522 -3.252291
H 6.426500 0.185378 -2.285509


