%chk=000297844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297844

0 1
O 3.623044 -0.422011 1.286005
O 2.435977 1.741630 -2.500197
O -3.399167 1.185034 1.338921
O 4.436073 -2.119346 0.010127
O 0.844628 2.151196 1.798853
O -3.158578 2.400459 -0.598118
N 4.230031 0.659046 -1.620058
N 1.553544 2.898713 -0.246854
N -1.802572 2.776524 1.275988
C 5.031360 0.223662 -0.468123
C 2.823455 2.146202 -0.162206
C 3.110649 1.495599 -1.511342
C 4.431191 -0.112641 -2.871972
C 4.354227 -0.943163 0.255077
C 2.784835 -1.320437 2.093192
C 1.488705 -1.575041 1.383830
C 0.604640 2.744909 0.757733
C -0.728451 3.464295 0.530223
C -4.480692 -0.558273 0.020402
C -4.685973 0.650998 0.886729
C 0.364380 -0.786362 1.665612
C 1.399823 -2.610382 0.440596
C -0.848399 -1.045252 1.021028
C 0.187674 -2.860792 -0.205885
C -4.112252 -0.403981 -1.324375
C -4.691666 -1.842144 0.543360
C -2.796578 2.131299 0.528333
C -0.937087 -2.081535 0.086814
C -3.973607 -1.526801 -2.143596
C -4.556092 -2.962693 -0.281647
C -4.201875 -2.806377 -1.625662
H 6.041415 -0.113451 -0.810989
H 5.209386 1.068415 0.238715
H 2.760932 1.375662 0.664416
H 3.645111 2.845910 0.119712
H 5.431275 0.092629 -3.286365
H 3.679589 0.190113 -3.630086
H 4.322960 -1.197655 -2.699327
H 1.298478 3.210977 -1.190560
H 3.356578 -2.243921 2.296449
H 2.674594 -0.719541 3.016931
H -0.646150 4.508926 0.926141
H -0.999120 3.562188 -0.550215
H -5.164466 0.422727 1.858982
H -5.246598 1.450019 0.363793
H 0.438937 0.042273 2.375496
H 2.283163 -3.209130 0.206541
H -1.504890 2.349734 2.165621
H -1.730659 -0.440410 1.245621
H 0.119001 -3.662088 -0.939037
H -3.928201 0.599490 -1.724388
H -4.961004 -1.971264 1.590479
H -1.885224 -2.277368 -0.416377
H -3.689246 -1.403388 -3.187819
H -4.726816 -3.958396 0.124305
H -4.102992 -3.679684 -2.268124


%chk=000297844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297844

0 1
O 3.815152 -0.722551 1.334749
O 3.034604 2.218353 -2.461320
O -3.821756 1.544114 1.351920
O 4.922418 -1.923716 -0.344742
O 0.686000 2.200207 1.765916
O -3.495919 2.539557 -0.772165
N 4.711281 1.047249 -1.342172
N 1.583109 2.729042 -0.316267
N -1.847305 2.567193 0.896711
C 5.291792 0.515848 -0.092055
C 2.903953 2.173918 -0.023751
C 3.556306 1.809848 -1.373381
C 5.335651 0.608500 -2.608831
C 4.686699 -0.855339 0.262648
C 3.030003 -1.953736 1.760531
C 1.717528 -2.055302 1.019183
C 0.554858 2.659734 0.583700
C -0.804760 3.182866 0.082933
C -5.063967 -0.322097 0.258479
C -5.160841 1.052309 0.888184
C 0.646257 -1.177342 1.333429
C 1.537013 -3.042840 0.017716
C -0.590111 -1.294954 0.661610
C 0.297189 -3.162420 -0.650402
C -4.803308 -0.460183 -1.130444
C -5.231595 -1.488114 1.048322
C -3.077402 2.251836 0.383223
C -0.770019 -2.292570 -0.326439
C -4.711701 -1.743257 -1.714788
C -5.139341 -2.771862 0.465393
C -4.880431 -2.901832 -0.919277
H 6.376001 0.380626 -0.247712
H 5.143428 1.215631 0.743713
H 2.793494 1.297886 0.639020
H 3.538966 2.909452 0.513904
H 6.368948 0.995734 -2.681079
H 4.737685 1.006031 -3.441970
H 5.356282 -0.494648 -2.657597
H 1.437753 2.978942 -1.304352
H 3.672072 -2.834487 1.591069
H 2.891811 -1.769460 2.837163
H -0.818215 4.289475 0.169511
H -0.976839 2.936918 -0.980205
H -5.753096 1.036298 1.816800
H -5.568883 1.794722 0.180826
H 0.781426 -0.388842 2.083692
H 2.368956 -3.708806 -0.239829
H -1.568223 2.240726 1.827626
H -1.414999 -0.617778 0.910111
H 0.164175 -3.931242 -1.419737
H -4.661188 0.441605 -1.736440
H -5.432703 -1.388512 2.122209
H -1.736490 -2.385571 -0.834422
H -4.516439 -1.839579 -2.788844
H -5.271877 -3.665659 1.085157
H -4.816102 -3.896820 -1.374526


