%chk=000297002.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297002

0 1
O -1.048412 -1.178579 1.026317
O 0.597752 1.724435 -2.210772
O 2.023814 2.577312 -0.827533
N 1.133685 1.797237 -1.117881
C -0.847732 1.063959 0.179830
C 0.622256 0.888449 -0.047543
C -1.600673 -0.202102 0.569170
C -3.078737 -0.171452 0.352920
C 1.421318 0.027597 0.598063
C 2.855617 -0.207680 0.378251
C -3.830669 1.006571 0.469854
C -3.720039 -1.381576 0.043489
C 3.281256 -1.520322 0.102987
C 3.799493 0.824767 0.478188
C -5.212321 0.973814 0.267417
C -5.101165 -1.408544 -0.166686
C 4.637841 -1.787308 -0.085695
C 5.157862 0.547291 0.296875
C -5.847176 -0.231318 -0.055496
C 5.578249 -0.754778 0.013035
H -1.327220 1.488649 -0.739477
H -1.004834 1.826566 0.979332
H 0.970102 -0.637748 1.363429
H -3.350325 1.949813 0.726982
H -3.131236 -2.300165 -0.026599
H 2.550948 -2.325917 0.029143
H 3.473687 1.847192 0.687562
H -5.796978 1.888335 0.360459
H -5.595080 -2.347951 -0.413182
H 4.965392 -2.801695 -0.308783
H 5.887388 1.352903 0.372372
H -6.925076 -0.251493 -0.218012
H 6.636314 -0.967162 -0.132315


%chk=000297002-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297002

0 1
O -0.893532 -1.115386 -0.656858
O 0.007594 3.280599 -1.225097
O 2.202756 2.716379 -1.158281
N 0.966783 2.477716 -0.861247
C -0.864639 1.177955 0.229980
C 0.614643 1.281387 -0.085261
C -1.551302 -0.134238 -0.205640
C -3.042870 -0.215529 -0.048910
C 1.488284 0.291926 0.325620
C 2.910184 -0.073872 0.271938
C -3.826542 0.861859 0.448188
C -3.687480 -1.430225 -0.413832
C 3.206868 -1.353535 0.851853
C 4.002375 0.678073 -0.263530
C -5.224549 0.723879 0.578772
C -5.082996 -1.565374 -0.284956
C 4.516389 -1.862129 0.891403
C 5.314292 0.165563 -0.215200
C -5.855781 -0.487917 0.212876
C 5.582630 -1.099768 0.356605
H -1.375384 2.030105 -0.252159
H -1.034781 1.294138 1.319938
H 0.918477 -0.485150 0.854101
H -3.358155 1.810564 0.728960
H -3.068419 -2.247897 -0.797392
H 2.385305 -1.953403 1.262750
H 3.809470 1.651115 -0.710382
H -5.821830 1.558863 0.960237
H -5.571042 -2.503198 -0.571165
H 4.708299 -2.845063 1.334510
H 6.135254 0.760594 -0.630018
H -6.942020 -0.591313 0.312432
H 6.607021 -1.487618 0.385466


