%chk=000287669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287669

0 1
O 1.655462 0.762637 0.238573
O -1.657333 0.744644 -0.377705
O 1.666652 -0.426774 2.166509
O -1.971374 0.305394 -2.575402
O 7.684261 -3.154343 -0.204270
O 7.450000 -2.028792 -2.038202
O -7.829411 -2.956041 -0.473615
O -7.116684 -2.862144 1.567935
N 7.088711 -2.373912 -0.926437
N -7.015434 -2.634757 0.374731
C 0.676705 2.928423 0.966245
C -0.747292 3.550708 0.638267
C -0.728630 3.009444 -0.842643
C 0.410086 1.422592 0.621240
C -0.436581 1.492574 -0.678535
C 1.562640 3.504794 -0.180807
C 0.597838 3.600665 -1.392763
C 1.221169 3.143548 2.355254
C -0.792778 5.076152 0.733806
C -1.893321 2.998751 1.485089
C 2.192100 -0.154246 1.112981
C -2.342381 0.185408 -1.432193
C 3.457841 -0.711761 0.554650
C -3.544623 -0.541469 -0.931620
C 4.181202 -1.615038 1.349345
C 3.913330 -0.351961 -0.721620
C -4.509865 -0.936233 -1.871300
C -3.704808 -0.832071 0.430436
C 5.371244 -2.162240 0.867490
C 5.102673 -0.895504 -1.210847
C -5.648679 -1.622348 -1.447050
C -4.840960 -1.519288 0.862372
C 5.819011 -1.794439 -0.408904
C -5.801523 -1.905038 -0.082474
H -1.620012 3.232573 -1.436946
H -0.075256 0.855928 1.441490
H 0.055030 1.029939 -1.558077
H 1.979359 4.485397 0.091013
H 2.420075 2.844869 -0.388573
H 0.458470 4.641095 -1.725881
H 0.971512 3.047382 -2.267682
H 0.567586 2.710579 3.123970
H 2.209488 2.682028 2.477456
H 1.326885 4.211295 2.584893
H -0.804127 5.403606 1.780394
H -1.696741 5.471644 0.256029
H 0.062134 5.568108 0.259149
H -2.057100 1.921864 1.356192
H -2.842582 3.482493 1.224274
H -1.717753 3.177422 2.551864
H 3.806464 -1.886568 2.342777
H 3.334109 0.352296 -1.328332
H -4.362031 -0.707688 -2.932647
H -2.939414 -0.519789 1.148614
H 5.952329 -2.869652 1.470925
H 5.477503 -0.629169 -2.206082
H -6.415768 -1.940110 -2.163131
H -4.987006 -1.757778 1.922478


%chk=000287669-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287669

0 1
O 1.701137 0.867360 0.184306
O -1.678752 0.771581 -0.272587
O 1.686828 -0.324074 2.199631
O -2.200950 0.650857 -2.544939
O 7.504982 -3.613051 -0.057933
O 7.413898 -2.420729 -2.000612
O -7.638967 -3.484153 -0.780019
O -7.038968 -3.322048 1.414809
N 6.962074 -2.737373 -0.834287
N -6.874001 -3.050681 0.164218
C 0.757722 3.114516 0.899507
C -0.714234 3.702819 0.734450
C -0.862764 3.157322 -0.734981
C 0.473254 1.608858 0.582910
C -0.513447 1.648251 -0.606703
C 1.490556 3.714220 -0.347025
C 0.376928 3.774769 -1.453635
C 1.475528 3.337051 2.232240
C -0.776453 5.245847 0.831823
C -1.753485 3.148255 1.742695
C 2.205274 -0.075156 1.085148
C -2.445079 0.336662 -1.354294
C 3.433547 -0.744172 0.552144
C -3.577094 -0.540856 -0.920516
C 4.065508 -1.716315 1.370672
C 3.965984 -0.431460 -0.725768
C -4.444479 -1.044569 -1.924800
C -3.796771 -0.868976 0.442811
C 5.224229 -2.375458 0.922629
C 5.124263 -1.084370 -1.186927
C -5.528640 -1.869986 -1.577370
C -4.878236 -1.693986 0.804440
C 5.734746 -2.045912 -0.352252
C -5.727316 -2.179853 -0.213796
H -1.821770 3.346555 -1.241573
H 0.044640 1.089579 1.456869
H -0.072741 1.255955 -1.538861
H 1.889592 4.715624 -0.109248
H 2.346775 3.084319 -0.642395
H 0.168963 4.811335 -1.767948
H 0.647275 3.209430 -2.362945
H 0.925439 2.883705 3.077059
H 2.484938 2.885566 2.217673
H 1.600354 4.415778 2.438533
H -0.639439 5.568301 1.880652
H -1.771048 5.603848 0.505433
H -0.018607 5.762651 0.221396
H -1.893530 2.057779 1.688107
H -2.739932 3.611246 1.553788
H -1.460200 3.409855 2.776682
H 3.632748 -1.938942 2.350763
H 3.466140 0.317101 -1.344907
H -4.250399 -0.776626 -2.967905
H -3.118025 -0.478560 1.204876
H 5.733798 -3.128023 1.529333
H 5.559077 -0.867631 -2.165800
H -6.213693 -2.272981 -2.327326
H -5.074778 -1.965957 1.844457


