%chk=000238716.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238716

0 1
O 2.932828 0.376174 -0.002613
O 2.180178 -1.785888 -0.001481
N 0.718196 0.073893 -0.001332
N 6.606907 0.903764 0.012145
C -1.731845 0.291832 0.000016
C -3.008780 -0.329008 0.000960
C -0.563701 -0.563659 -0.000396
C -1.662715 1.720350 -0.000480
C -3.112428 -1.755782 0.001469
C -0.690851 -1.938545 0.000112
C -4.184538 0.489684 0.001391
C -1.981101 -2.531413 0.001052
C -2.804556 2.482226 -0.000052
C -4.084832 1.857639 0.000899
C 1.941676 -0.598817 -0.001775
C 4.305273 -0.135393 -0.003577
C 5.148536 1.149479 -0.003998
H -0.686702 2.207477 -0.001208
H -4.101845 -2.208588 0.002192
H 0.188151 -2.592471 -0.000192
H -5.157782 0.000025 0.002118
H -2.047902 -3.620209 0.001432
H 0.740306 1.101514 -0.001775
H -2.750806 3.569743 -0.000430
H -4.975363 2.485111 0.001224
H 4.442336 -0.755808 0.898187
H 4.441147 -0.755727 -0.905537
H 4.896460 1.766471 -0.897661
H 4.878542 1.778065 0.876390
H 6.901367 0.371028 -0.800216
H 6.885443 0.384032 0.838437


%chk=000238716-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238716

0 1
O 2.916305 0.401354 0.001203
O 2.194271 -1.840631 0.001954
N 0.696140 0.008026 0.000603
N 6.660114 0.866542 0.001923
C -1.748272 0.269010 -0.000280
C -3.063814 -0.342198 -0.000373
C -0.586721 -0.601302 0.000486
C -1.669060 1.702678 -0.000952
C -3.189128 -1.769746 0.000273
C -0.743445 -1.996604 0.001102
C -4.225724 0.499264 -0.001114
C -2.047871 -2.571129 0.000989
C -2.819844 2.495734 -0.001669
C -4.113970 1.889870 -0.001750
C 1.935779 -0.611932 0.001301
C 4.326509 -0.073113 0.002039
C 5.224495 1.181497 0.001269
H -0.701228 2.218837 -0.000929
H -4.189892 -2.215930 0.000191
H 0.142030 -2.634992 0.001676
H -5.213358 0.022965 -0.001174
H -2.140432 -3.662510 0.001479
H 0.743707 1.027068 0.000176
H -2.729939 3.587328 -0.002171
H -5.010289 2.519227 -0.002312
H 4.497577 -0.696700 0.899792
H 4.498191 -0.698161 -0.894580
H 4.989702 1.796577 -0.886168
H 4.989237 1.798076 0.887537
H 7.020497 0.433318 -0.851031
H 7.020033 0.434778 0.855811


