%chk=000278613.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278613

0 1
O 3.551164 -0.501216 1.140422
O 1.279124 -0.275782 0.846077
O 2.003469 3.409446 -0.867170
O 1.154483 -1.306853 -2.512263
O 2.204076 -2.633394 -1.051189
N 0.365442 2.337270 0.319075
N -4.318233 0.663952 0.887113
C 2.558134 0.168413 0.349815
C 2.716237 1.660934 0.613385
C 2.703596 -0.219014 -1.133387
C 2.959124 -1.672786 1.761677
C 1.455859 -1.376716 1.780183
C 1.681624 2.537604 -0.074047
C -1.641916 2.234350 -1.177871
C -0.732618 3.115588 -0.301935
C -2.550311 1.378189 -0.374345
C -2.366622 -0.027442 -0.094596
C 2.049076 -1.515937 -1.485858
C -3.491940 -0.451704 0.691245
C -3.735853 1.770985 0.230586
C -1.376956 -0.968663 -0.432512
C -3.637490 -1.785218 1.129172
C -1.525417 -2.277303 -0.006515
C -2.647149 -2.679639 0.766402
H 3.731890 1.993837 0.295977
H 2.696882 1.841476 1.712199
H 2.310099 0.598681 -1.786805
H 3.792632 -0.285130 -1.374070
H 3.223321 -2.545333 1.132968
H 3.437238 -1.732172 2.750832
H 1.073336 -1.013986 2.747167
H 0.826570 -2.195258 1.388105
H -1.022434 1.608132 -1.856621
H -2.233853 2.888493 -1.853501
H -1.321683 3.590939 0.514645
H -0.295769 3.940058 -0.917529
H 0.091403 1.495051 0.837316
H -4.204157 2.738235 0.242624
H -5.181251 0.677327 1.391639
H -0.507009 -0.653025 -1.011293
H -4.494110 -2.087962 1.720386
H -0.777312 -3.024236 -0.264601
H -2.718863 -3.722154 1.074702
H 0.696969 -2.141135 -2.806302


%chk=000278613-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278613

0 1
O 3.552076 -0.574909 1.185983
O 1.238641 -0.386474 0.708932
O 2.110775 3.726641 -0.411096
O 1.444810 -1.223636 -2.735034
O 2.659234 -2.520789 -1.249929
N 0.392602 2.207933 0.020858
N -4.156275 0.722712 1.193265
C 2.578262 0.167661 0.365422
C 2.682141 1.652611 0.771086
C 2.813982 -0.040115 -1.152508
C 2.847479 -1.734938 1.794572
C 1.400068 -1.228944 1.921155
C 1.708951 2.617456 0.065822
C -1.743757 2.172210 -1.297242
C -0.658758 3.030610 -0.595226
C -2.583014 1.330463 -0.358754
C -2.476769 -0.101864 -0.116527
C 2.337461 -1.385638 -1.662564
C -3.476447 -0.453797 0.861041
C -3.619440 1.790337 0.456702
C -1.639026 -1.124505 -0.638341
C -3.654859 -1.777303 1.322732
C -1.812012 -2.445476 -0.182262
C -2.809295 -2.769846 0.786869
H 3.701426 2.014810 0.556618
H 2.535010 1.708843 1.865627
H 2.310998 0.754674 -1.724242
H 3.902214 0.040622 -1.327407
H 2.924499 -2.606999 1.124346
H 3.333260 -1.930097 2.763405
H 1.251187 -0.613077 2.828772
H 0.632489 -2.015558 1.859269
H -1.253989 1.526646 -2.050227
H -2.395591 2.870931 -1.856328
H -1.140505 3.670383 0.172749
H -0.164231 3.705270 -1.316856
H 0.161192 1.283265 0.409049
H -4.020535 2.797481 0.560776
H -4.929458 0.791884 1.850887
H -0.858581 -0.887380 -1.369153
H -4.421222 -2.030653 2.064102
H -1.171381 -3.243868 -0.574464
H -2.921470 -3.808843 1.116999
H 1.168660 -2.121831 -3.067577


