%chk=000270873.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270873

0 1
O 4.414349 1.222421 1.076869
O 2.430875 2.114930 0.560665
N -1.714760 -2.841420 0.663865
C 0.310857 -0.096792 -0.107069
C 1.370430 -0.671932 0.853740
C -1.117482 -0.299541 0.465379
C 0.484975 -0.714293 -1.507943
C 2.789274 -0.337568 0.359616
C -2.178897 0.436403 -0.380395
C 1.917148 -0.729867 -1.948732
C 2.953305 -0.564754 -1.120843
C -3.535928 0.500391 0.331347
C 3.109291 1.119893 0.646181
C -4.572744 1.254815 -0.513092
C -1.450828 -1.720057 0.573884
C -5.926675 1.321291 0.189110
H 0.486391 1.011681 -0.187277
H -1.132915 0.137505 1.504969
H 1.266665 -1.774440 0.920876
H 1.218859 -0.287233 1.879470
H -0.130286 -0.156204 -2.242852
H 0.099111 -1.757722 -1.525873
H 3.529391 -0.981706 0.909295
H -2.292390 -0.058870 -1.364676
H -1.820789 1.463057 -0.597915
H 2.066781 -0.907063 -3.015438
H 3.985416 -0.588229 -1.467944
H -3.903151 -0.523325 0.545322
H -3.428242 0.992488 1.317341
H -4.212514 2.280287 -0.727312
H -4.688006 0.761443 -1.498405
H -6.331115 0.320967 0.383801
H -5.859159 1.839740 1.152385
H -6.662711 1.858032 -0.420354
H 4.690177 2.158470 1.264104


%chk=000270873-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270873

0 1
O 4.613360 1.246407 0.619484
O 2.485587 1.994080 1.161118
N -1.731966 -2.861693 0.745235
C 0.326849 -0.089314 -0.082902
C 1.384393 -0.687452 0.877285
C -1.121991 -0.271113 0.478978
C 0.500693 -0.676526 -1.504208
C 2.824367 -0.364733 0.419722
C -2.206707 0.465898 -0.364922
C 1.954721 -0.730182 -1.931470
C 3.005278 -0.573174 -1.085783
C -3.595470 0.502568 0.308615
C 3.231936 1.065328 0.779649
C -4.647058 1.257536 -0.536326
C -1.462279 -1.703728 0.633607
C -6.034408 1.303357 0.138966
H 0.497605 1.004425 -0.125713
H -1.133034 0.170997 1.498382
H 1.268209 -1.787740 0.912388
H 1.222378 -0.301836 1.901264
H -0.069998 -0.077856 -2.240804
H 0.070347 -1.700648 -1.546621
H 3.543475 -1.026654 0.942013
H -2.292605 -0.011268 -1.359937
H -1.846684 1.501199 -0.531797
H 2.153025 -0.914095 -2.996458
H 4.036344 -0.598140 -1.456977
H -3.948512 -0.532422 0.491081
H -3.511352 0.986493 1.304249
H -4.291688 2.291220 -0.725704
H -4.733671 0.770577 -1.529096
H -6.424447 0.282928 0.312567
H -5.981917 1.813253 1.119449
H -6.769437 1.844722 -0.484255
H 4.849365 2.190383 0.831020


