%chk=000201170.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201170

0 1
O -2.524855 -1.764418 1.588305
O -4.777094 -1.273443 -0.104253
N 0.119752 2.743285 0.259804
N 1.537850 -0.575078 -0.995313
C 0.130541 1.581018 -0.692147
C 1.341686 0.716638 -0.470872
C 2.468404 1.111041 0.243274
C 2.571068 2.428788 0.917894
C 1.464144 3.376157 0.398630
C 3.416964 0.030645 0.189599
C 2.807099 -1.018362 -0.585679
C -1.177314 0.824970 -0.550426
C 4.710527 -0.166759 0.707075
C 3.468091 -2.237991 -0.837930
C -1.333223 -0.148757 0.447722
C -2.239782 1.119784 -1.408069
C 5.354501 -1.365866 0.455368
C 4.737234 -2.390906 -0.309591
C -2.546566 -0.833351 0.576469
C -3.460435 0.441630 -1.289253
C -3.623161 -0.533567 -0.306012
C -3.745253 -2.492646 1.874631
C -5.933584 -0.931544 -0.906070
H 0.205313 2.019773 -1.729361
H 2.486337 2.294060 2.016081
H 3.567794 2.881420 0.745933
H 1.351756 4.247273 1.078573
H 1.758005 3.783243 -0.594080
H -0.207485 2.425302 1.181217
H 0.852928 -1.108787 -1.494077
H 5.182631 0.618104 1.292734
H 2.993518 -3.018573 -1.422053
H -0.519472 -0.386051 1.136060
H -2.132104 1.891158 -2.169684
H 6.354497 -1.540649 0.845844
H 5.286543 -3.316312 -0.477376
H -4.271256 0.689634 -1.969316
H -3.437626 -3.122296 2.717114
H -4.036539 -3.092013 1.005183
H -4.541862 -1.797177 2.157382
H -6.685896 -1.630359 -0.518739
H -5.731626 -1.120697 -1.964199
H -6.231752 0.105278 -0.725589


%chk=000201170-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201170

0 1
O -2.724120 -1.617414 1.761288
O -4.984980 -1.007545 0.134028
N 0.145134 2.790384 0.053660
N 1.562077 -0.615195 -0.937340
C 0.127449 1.543400 -0.779204
C 1.347653 0.693970 -0.470389
C 2.464845 1.116361 0.251064
C 2.562722 2.502217 0.843218
C 1.488820 3.414871 0.173648
C 3.411943 0.017301 0.255302
C 2.815880 -1.060261 -0.497966
C -1.208308 0.821420 -0.593904
C 4.705292 -0.167591 0.811321
C 3.470274 -2.295040 -0.694004
C -1.391934 -0.136680 0.433956
C -2.311056 1.149369 -1.413693
C 5.364068 -1.398067 0.616059
C 4.752939 -2.451042 -0.126934
C -2.641249 -0.752228 0.657030
C -3.569979 0.544304 -1.208775
C -3.754337 -0.397646 -0.168409
C -3.330793 -2.949622 1.561395
C -6.156637 -0.584918 -0.638025
H 0.186739 1.870758 -1.840914
H 2.404644 2.477149 1.941933
H 3.571352 2.933714 0.682019
H 1.376782 4.359823 0.736039
H 1.824688 3.676139 -0.848622
H -0.275675 2.604405 0.976504
H 0.871610 -1.172331 -1.436739
H 5.184410 0.633170 1.386374
H 3.006585 -3.107063 -1.265773
H -0.563508 -0.425983 1.089960
H -2.190772 1.894756 -2.207851
H 6.362350 -1.554148 1.040482
H 5.290306 -3.396770 -0.260606
H -4.409020 0.824873 -1.852618
H -3.218214 -3.456660 2.531791
H -2.780948 -3.510543 0.780424
H -4.394247 -2.865042 1.286008
H -6.999372 -1.146337 -0.208583
H -6.047058 -0.838391 -1.710380
H -6.336057 0.501730 -0.527971


