%chk=000180885.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180885

0 1
O 2.561675 -0.736237 1.576461
O -0.605613 -0.877053 -1.512714
N -0.131275 0.568576 0.173972
N 1.679475 -1.908537 -0.197388
N 2.535575 -4.181291 0.524538
C 2.011353 1.798718 0.414733
C 3.438061 1.961487 -0.160504
C 1.318129 0.537166 -0.117968
C 3.403565 2.251449 -1.664653
C 4.168872 3.080928 0.588976
C 1.928031 -0.725284 0.549721
C -1.030340 -0.153023 -0.619949
C -2.472013 0.014701 -0.275716
C -3.252653 -1.135346 -0.091968
C -3.047939 1.288583 -0.173539
C -4.610080 -1.006620 0.214982
C -4.406772 1.408886 0.127995
C -5.185917 0.263137 0.326125
C 2.142456 -3.137577 0.207828
H 2.071858 1.758092 1.523784
H 1.409239 2.694731 0.167744
H 3.997628 1.005498 0.009409
H 1.462953 0.470567 -1.238020
H 2.887738 1.461842 -2.222644
H 4.418086 2.326056 -2.074389
H 2.896827 3.196904 -1.887210
H 4.257996 2.856986 1.658652
H 5.187011 3.213165 0.203751
H 3.658417 4.044607 0.491507
H -0.433450 1.092364 0.991108
H 1.032393 -1.899078 -1.016696
H -2.801027 -2.124115 -0.196445
H -2.446288 2.181455 -0.341916
H -5.219817 -1.898076 0.362345
H -4.860963 2.396213 0.205575
H -6.245690 0.360927 0.563513


%chk=000180885-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180885

0 1
O 2.885697 -0.666845 1.514188
O -0.608540 -1.177934 -1.275335
N -0.086412 0.502023 0.229162
N 1.642485 -1.960266 -0.009917
N 2.490115 -4.257964 0.711406
C 2.023315 1.804672 0.338612
C 3.460936 2.020262 -0.211656
C 1.362179 0.482152 -0.091999
C 3.488298 2.145705 -1.753952
C 4.075603 3.278743 0.445074
C 2.057041 -0.744853 0.576047
C -1.004024 -0.271048 -0.450554
C -2.457087 -0.030188 -0.189274
C -3.366631 -1.069650 -0.513916
C -2.950791 1.190060 0.345494
C -4.747383 -0.901673 -0.285359
C -4.333731 1.356245 0.571096
C -5.233692 0.309242 0.262139
C 2.100131 -3.173021 0.388610
H 2.064371 1.834247 1.445479
H 1.381881 2.641716 -0.006174
H 4.074158 1.148594 0.088678
H 1.430758 0.345870 -1.188039
H 3.112701 1.238632 -2.263337
H 4.521936 2.311259 -2.108524
H 2.875764 3.004685 -2.091013
H 4.112685 3.177917 1.545365
H 5.107071 3.446736 0.085734
H 3.483075 4.182645 0.202200
H -0.390850 1.099060 1.000740
H 0.850709 -1.882820 -0.706596
H -2.969238 -1.993839 -0.945202
H -2.274191 2.028726 0.550106
H -5.443321 -1.710073 -0.532708
H -4.710701 2.301510 0.975683
H -6.306813 0.440277 0.438741


