%chk=000227976.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227976

0 1
O 5.455498 -0.460824 0.787835
O 3.977408 -1.974784 1.237288
N 4.312253 -0.886743 0.798561
N -5.581409 -0.710425 0.086466
C 0.920804 0.357282 -0.288779
C 1.925766 -0.468578 0.238498
C -0.472454 -0.115679 -0.289604
C 3.251314 -0.016874 0.235767
C 1.264672 1.614652 -0.817855
C -2.906766 0.176301 0.049537
C -1.514997 0.656977 0.043935
C 3.599805 1.236849 -0.288042
C 2.593989 2.047566 -0.816950
C -3.422951 -0.580377 -1.013925
C -3.748088 0.487492 1.130575
C -4.761159 -1.000899 -0.956269
C -5.071651 0.022893 1.111069
H 1.686381 -1.453486 0.655462
H -0.604272 -1.166532 -0.569043
H 0.487061 2.254443 -1.239841
H -1.387265 1.698628 0.353772
H 4.645292 1.562813 -0.278236
H 2.848515 3.024122 -1.231979
H -2.803906 -0.831280 -1.871423
H -3.382072 1.070032 1.972333
H -5.205212 -1.592374 -1.766255
H -5.761157 0.237706 1.936603


%chk=000227976-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227976

0 1
O 5.649826 -0.630512 -0.299447
O 4.103506 -2.296512 -0.477001
N 4.432494 -1.057996 -0.321304
N -5.699923 -0.732417 -0.023146
C 0.945174 0.421689 -0.026349
C 2.007123 -0.510058 -0.179984
C -0.437561 -0.081236 -0.058327
C 3.340974 -0.060746 -0.156515
C 1.282695 1.798165 0.149885
C -2.959298 0.150506 0.030487
C -1.580601 0.662700 0.065435
C 3.679946 1.297528 0.016420
C 2.625315 2.224188 0.170394
C -3.298894 -1.223629 -0.140356
C -4.044881 1.060972 0.173257
C -4.654136 -1.607201 -0.159891
C -5.372577 0.584455 0.140822
H 1.809561 -1.577597 -0.318205
H -0.528406 -1.167279 -0.197660
H 0.489350 2.542671 0.272239
H -1.499292 1.750002 0.204601
H 4.730112 1.599381 0.027316
H 2.856326 3.285412 0.307246
H -2.527189 -1.991008 -0.257460
H -3.854485 2.132050 0.308300
H -4.932740 -2.658957 -0.290827
H -6.217019 1.274328 0.249572


