%chk=000189083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189083

0 1
O 1.815673 -2.903276 0.372690
O -0.401075 2.756103 -1.251687
N -1.210814 -1.342048 0.908939
N 1.985392 2.255846 0.548878
C -0.002905 -0.567697 0.456513
C 0.578128 -1.131197 -0.855214
C -0.522199 0.900037 0.251112
C 1.753769 -0.231249 -1.297542
C 0.901102 -2.626395 -0.711085
C -2.015283 0.683028 0.083488
C 1.107449 1.042474 -1.859660
C 0.052429 1.666644 -0.961077
C -0.214309 1.748930 1.504915
C -1.069397 -2.815004 0.907967
C -0.374350 -3.400771 -0.335094
C -2.359822 -0.666138 0.418681
C 2.765726 -0.001074 -0.190294
C 1.296869 1.809027 1.801277
C 3.168699 1.414020 0.185362
C -2.994619 1.576361 -0.303778
C 3.382677 -1.018736 0.431206
C -3.679498 -1.107169 0.350536
C 3.174540 -2.476658 0.155811
C -4.330676 1.133585 -0.370918
C -4.659559 -0.181345 -0.046694
C 2.348045 3.700150 0.601076
H 0.760056 -0.640873 1.272249
H -0.215276 -1.066822 -1.649401
H 2.306095 -0.736600 -2.133508
H 1.347524 -3.025507 -1.649263
H 0.635348 0.830833 -2.841948
H 1.870326 1.818655 -2.079986
H -0.750716 1.328721 2.377744
H -0.618542 2.770707 1.350840
H -2.064346 -3.286086 1.050698
H -0.451459 -3.061700 1.807920
H -0.110453 -4.458060 -0.132005
H -1.065662 -3.408354 -1.198309
H 1.483904 2.481164 2.663458
H 1.653219 0.800236 2.112223
H 3.940943 1.399857 0.987754
H 3.662143 1.878760 -0.702160
H -2.730251 2.603490 -0.567288
H 4.110556 -0.827685 1.221788
H -3.951318 -2.124615 0.604033
H 3.500134 -2.749153 -0.865807
H 3.710230 -3.111698 0.891189
H -5.105896 1.829364 -0.679510
H -5.698029 -0.506883 -0.101926
H 3.080377 3.967812 1.375283
H 1.424695 4.284092 0.768948
H 2.738204 4.015895 -0.380123


%chk=000189083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189083

0 1
O 1.872001 -2.978864 0.396581
O -0.245572 2.895167 -1.082581
N -1.220261 -1.343138 0.832819
N 1.991891 2.202121 0.629788
C 0.003464 -0.585033 0.464459
C 0.617932 -1.156604 -0.834492
C -0.474885 0.901782 0.314586
C 1.800717 -0.246918 -1.281453
C 0.902739 -2.669915 -0.676473
C -1.985163 0.710607 0.066746
C 1.150557 1.047036 -1.824769
C 0.201483 1.729863 -0.827542
C -0.221955 1.693616 1.636741
C -1.085981 -2.801369 0.934921
C -0.398961 -3.416723 -0.318197
C -2.351569 -0.628212 0.408215
C 2.847124 -0.016850 -0.174991
C 1.303076 1.802491 1.884567
C 3.186789 1.413029 0.235028
C -2.956290 1.631772 -0.348440
C 3.494491 -1.059701 0.418622
C -3.699937 -1.048412 0.334079
C 3.246961 -2.521292 0.094082
C -4.314151 1.217414 -0.431617
C -4.672165 -0.107633 -0.089175
C 2.117159 3.659437 0.450080
H 0.749788 -0.700907 1.268551
H -0.151780 -1.087178 -1.633406
H 2.321203 -0.754596 -2.124456
H 1.315368 -3.063504 -1.635926
H 0.557400 0.791967 -2.727446
H 1.889677 1.801535 -2.149624
H -0.719138 1.191142 2.487717
H -0.671750 2.697050 1.525777
H -2.082550 -3.250680 1.085355
H -0.473701 -3.040816 1.824830
H -0.164438 -4.480741 -0.130516
H -1.085317 -3.364210 -1.185019
H 1.512304 2.529573 2.698433
H 1.708434 0.828405 2.211569
H 3.960085 1.394034 1.037751
H 3.640327 1.940755 -0.628350
H -2.654728 2.648861 -0.618739
H 4.227235 -0.846017 1.209429
H -3.996544 -2.069901 0.596311
H 3.465484 -2.730777 -0.979041
H 3.895292 -3.165606 0.710432
H -5.082585 1.924618 -0.761547
H -5.721612 -0.419600 -0.153676
H 2.779082 4.127685 1.212239
H 1.115060 4.118695 0.501434
H 2.515708 3.879538 -0.555365


