%chk=000284921.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284921

0 1
O 2.320570 0.544482 0.182350
O -0.769184 2.563361 -3.156878
O -5.122694 -1.302776 1.739430
O 3.630420 0.920057 1.981119
N -2.591106 1.522817 -2.331187
C 1.581878 1.801419 0.431142
C 0.640991 1.606239 1.618319
C 0.875655 2.039654 -0.904341
C -0.447331 0.576208 1.305957
C -1.182744 0.916245 0.039940
C -0.554008 1.593134 -0.957933
C -2.573920 0.490486 -0.115227
C -1.240452 1.946397 -2.214886
C -3.260736 0.805372 -1.317432
C -3.262629 -0.225803 0.880414
C -4.607020 0.408558 -1.509919
C -4.589544 -0.608569 0.671215
C -5.274209 -0.296481 -0.522570
C 3.342653 0.212390 1.039021
C 3.976809 -1.063796 0.630822
C 5.057153 -1.539706 1.391868
C 3.521708 -1.785309 -0.482761
C -6.494928 -1.749813 1.636621
C 5.678422 -2.738252 1.035644
C 4.148498 -2.983640 -0.832873
C 5.224539 -3.458794 -0.075145
H 2.346106 2.582582 0.644569
H 0.182336 2.580694 1.882974
H 1.224274 1.292243 2.509997
H 1.444403 1.514155 -1.712517
H 0.934841 3.118340 -1.175906
H -1.139351 0.491411 2.169000
H 0.017282 -0.429846 1.182187
H -3.090947 1.751860 -3.192609
H -2.775736 -0.488374 1.820931
H -5.118693 0.659362 -2.438825
H -6.307074 -0.600155 -0.672116
H 5.402035 -0.965990 2.256542
H 2.680661 -1.402935 -1.067784
H -6.635983 -2.253847 2.602638
H -6.606096 -2.456229 0.809293
H -7.169765 -0.894531 1.541879
H 6.516741 -3.110984 1.622485
H 3.799033 -3.546660 -1.697142
H 5.712040 -4.393973 -0.351302


%chk=000284921-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000284921

0 1
O 2.190094 0.656729 0.178603
O -0.619748 2.643865 -3.191271
O -4.921172 -1.495217 1.759544
O 3.850761 0.985050 1.786747
N -2.410602 1.422427 -2.344923
C 1.655529 2.036008 0.460555
C 0.743938 1.982880 1.695754
C 0.886686 2.458708 -0.791368
C -0.434311 1.007874 1.489440
C -1.114873 1.155259 0.135908
C -0.492266 1.837090 -0.899398
C -2.430070 0.543720 -0.072410
C -1.139777 2.009819 -2.214220
C -3.070945 0.697873 -1.347455
C -3.103475 -0.205327 0.927465
C -4.343261 0.124372 -1.584615
C -4.367708 -0.777430 0.684826
C -4.997170 -0.610450 -0.579430
C 3.304873 0.255028 0.919562
C 3.756544 -1.118624 0.548111
C 4.884778 -1.655003 1.221694
C 3.094522 -1.884341 -0.447026
C -6.233035 -2.112556 1.556878
C 5.347883 -2.947675 0.902270
C 3.561701 -3.177648 -0.762636
C 4.687123 -3.711233 -0.090191
H 2.525326 2.691091 0.645609
H 0.358563 3.007715 1.865199
H 1.330009 1.699866 2.586930
H 1.465954 2.215763 -1.700289
H 0.791741 3.563237 -0.799184
H -1.172025 1.160422 2.299398
H -0.076589 -0.036959 1.590117
H -2.855013 1.547110 -3.259597
H -2.654521 -0.364648 1.911176
H -4.822975 0.252869 -2.562176
H -5.979611 -1.044379 -0.785902
H 5.378872 -1.043562 1.984031
H 2.228518 -1.457886 -0.960875
H -6.462885 -2.615045 2.507770
H -6.206934 -2.859166 0.738944
H -7.009280 -1.352144 1.341622
H 6.219386 -3.360101 1.421988
H 3.052368 -3.768647 -1.531504
H 5.047977 -4.715728 -0.338668


