%chk=000210664.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210664

0 1
O -2.141854 -2.808460 -0.171513
O 5.398517 3.737545 -0.186884
N -4.806341 0.474683 0.067476
N 1.727297 -0.459991 -0.067410
N 0.390153 -0.246862 -0.112068
C -4.819736 1.410067 -1.106066
C -6.203614 0.110296 0.478760
C -5.577265 2.697844 -0.741734
C -6.982273 1.378769 0.866259
C 0.796955 -2.503103 0.008608
C -7.009443 2.385482 -0.290456
C 2.028779 -1.833038 0.009954
C 0.666503 -3.975041 0.106778
C 3.358298 -2.486489 0.085860
C -4.014271 -0.760842 -0.241666
C 2.022881 -4.655548 -0.154870
C 3.178894 -3.942306 0.567465
C -0.205293 -1.485074 -0.070914
C -2.519454 -0.442603 -0.092974
C -1.672539 -1.688400 -0.119065
C 2.648138 0.648539 -0.079600
C 3.798458 0.587151 -0.894022
C 2.381434 1.779502 0.708970
C 4.695242 1.644953 -0.893981
C 3.274916 2.852128 0.709454
C 4.425100 2.773741 -0.087134
C 5.229405 4.956570 0.578565
H -5.267227 0.952076 -2.014355
H -3.764629 1.658232 -1.353350
H -6.131374 -0.562352 1.361207
H -6.753354 -0.444170 -0.311684
H -5.583453 3.383876 -1.607232
H -5.037221 3.221386 0.072604
H -6.504521 1.843824 1.752046
H -8.009085 1.106824 1.168997
H -7.521959 3.313172 0.022998
H -7.595719 1.979273 -1.135963
H -0.107783 -4.341921 -0.602861
H 0.279753 -4.245259 1.113385
H 4.039594 -1.939705 0.768943
H 3.843167 -2.478776 -0.913410
H -4.215763 -1.178662 -1.251162
H -4.283263 -1.564455 0.482149
H 1.975666 -5.712201 0.167226
H 2.220622 -4.673424 -1.244258
H 4.120586 -4.500127 0.413763
H 2.988225 -3.946143 1.658826
H -2.344131 0.110560 0.859162
H -2.179992 0.268087 -0.876149
H 3.977861 -0.282539 -1.528251
H 1.472123 1.822152 1.315215
H 5.595571 1.630209 -1.506453
H 3.064819 3.725322 1.320050
H 6.130369 5.519872 0.299872
H 4.324940 5.483128 0.260559
H 5.221592 4.735130 1.649534


%chk=000210664-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210664

0 1
O -2.171520 -2.857505 0.070414
O 5.337612 3.840272 -0.180419
N -4.816323 0.495431 0.129947
N 1.775243 -0.561055 -0.092809
N 0.408499 -0.309456 -0.067454
C -4.664027 1.580564 -0.873775
C -6.245959 0.123699 0.297340
C -5.458749 2.838051 -0.466441
C -7.090010 1.332936 0.748011
C 0.820770 -2.596710 -0.001106
C -6.952321 2.500830 -0.255298
C 2.056512 -1.937664 -0.046786
C 0.684635 -4.097286 0.073893
C 3.402697 -2.610449 0.028938
C -3.982036 -0.693907 -0.178917
C 2.052367 -4.780421 -0.192367
C 3.207506 -4.061691 0.548770
C -0.171871 -1.557077 -0.012756
C -2.481484 -0.423090 0.019847
C -1.643886 -1.701414 0.022800
C 2.675113 0.555974 -0.105091
C 3.950560 0.468970 -0.720149
C 2.264463 1.774920 0.481573
C 4.809753 1.580587 -0.720654
C 3.119270 2.895436 0.475518
C 4.402255 2.798459 -0.121456
C 4.959187 5.125543 0.413811
H -5.013214 1.236436 -1.885868
H -3.592477 1.832712 -0.966745
H -6.305793 -0.683569 1.051151
H -6.672566 -0.282844 -0.659733
H -5.339413 3.615833 -1.245659
H -5.033909 3.237142 0.475144
H -6.737165 1.659643 1.745576
H -8.148984 1.025553 0.848921
H -7.505743 3.389810 0.102780
H -7.403740 2.206710 -1.225948
H -0.082612 -4.447001 -0.639602
H 0.301219 -4.382687 1.073906
H 4.093429 -2.051958 0.689347
H 3.880728 -2.649289 -0.971730
H -4.161128 -1.071447 -1.218313
H -4.279920 -1.510920 0.502251
H 2.004370 -5.839924 0.121139
H 2.265074 -4.775785 -1.280585
H 4.152909 -4.621584 0.421099
H 2.985444 -4.036090 1.633783
H -2.335156 0.089876 0.992630
H -2.063467 0.264596 -0.737744
H 4.265478 -0.448776 -1.222525
H 1.270067 1.833603 0.931020
H 5.794991 1.532324 -1.193411
H 2.778120 3.826115 0.937810
H 5.825579 5.782708 0.250463
H 4.067536 5.552557 -0.084947
H 4.766390 5.025210 1.499611


