%chk=000288416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288416

0 1
O -1.110481 -1.587326 -1.670683
O 4.553529 -0.490901 2.207943
O 4.136726 1.465953 0.151887
N -0.589182 -2.603778 0.300297
C -1.695385 -0.388610 0.375094
C -1.072638 0.935582 -0.024447
C -3.201966 -0.325067 0.212036
C 0.186355 -3.673433 -0.375527
C -1.100346 -1.540499 -0.449240
C 1.668742 -3.672254 0.038163
C 2.309942 -2.310915 0.025606
C -0.649657 1.820543 0.979289
C -3.994728 -0.055170 1.338449
C -0.936895 1.299724 -1.372105
C -3.810544 -0.511033 -1.037209
C 3.155959 -1.946520 1.085146
C 2.081931 -1.409833 -1.019684
C 3.754038 -0.680501 1.104118
C -0.103407 3.060098 0.634259
C -5.384337 0.023394 1.212374
C -0.390028 2.539272 -1.710775
C -5.200161 -0.433043 -1.156383
C 2.669314 -0.139829 -1.006870
C 3.498846 0.237319 0.049464
C 0.024659 3.423908 -0.709703
C -5.990078 -0.166022 -0.033620
C 5.237519 0.780104 2.344724
C 3.644993 2.526879 -0.703557
H -1.470568 -0.565773 1.462518
H -0.277690 -4.652865 -0.120729
H 0.088170 -3.550719 -1.483250
H 1.774743 -4.137484 1.040012
H 2.233273 -4.339109 -0.650684
H -0.430340 -2.511519 1.298810
H -0.748096 1.551090 2.028769
H -3.533961 0.100450 2.311322
H -1.253797 0.603572 -2.155978
H -3.195304 -0.724443 -1.917228
H 3.364648 -2.630642 1.905612
H 1.424720 -1.680770 -1.848792
H 0.218185 3.744889 1.417023
H -5.995857 0.233923 2.088016
H -0.294204 2.818271 -2.758936
H -5.667575 -0.580706 -2.128901
H 2.464195 0.546302 -1.826234
H 0.435228 4.395212 -0.975554
H -7.071993 -0.105047 -0.129395
H 5.807165 0.631564 3.268309
H 5.895134 0.948328 1.484494
H 4.506573 1.589161 2.440912
H 2.567546 2.668495 -0.561601
H 4.210770 3.391082 -0.336287
H 3.891917 2.311292 -1.746871


%chk=000288416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288416

0 1
O -1.082477 -1.474286 -1.755551
O 4.097695 0.160657 2.471487
O 4.138505 1.695883 0.073308
N -0.614090 -2.516847 0.271757
C -1.910121 -0.414285 0.331568
C -1.243945 0.950390 0.066776
C -3.426041 -0.428873 0.089627
C 0.234556 -3.567403 -0.308971
C -1.173566 -1.504419 -0.489922
C 1.682410 -3.543791 0.254574
C 2.359142 -2.180802 0.159122
C -0.100831 1.313969 0.822756
C -4.287481 -0.095603 1.166907
C -1.715040 1.837828 -0.930486
C -3.998130 -0.736658 -1.171430
C 2.986466 -1.612212 1.294484
C 2.374306 -1.440892 -1.047042
C 3.596998 -0.340419 1.253550
C 0.558183 2.541675 0.594933
C -5.688937 -0.072689 0.994775
C -1.060290 3.069157 -1.158946
C -5.401270 -0.718484 -1.342590
C 2.979361 -0.168060 -1.109733
C 3.580219 0.404232 0.035369
C 0.076291 3.427300 -0.397113
C -6.252402 -0.386239 -0.263936
C 5.483622 0.672960 2.477896
C 4.036370 2.505219 -1.145665
H -1.748649 -0.638258 1.405198
H -0.213699 -4.564480 -0.129319
H 0.226401 -3.392137 -1.398278
H 1.671899 -3.874829 1.311851
H 2.260123 -4.310523 -0.301554
H -0.701179 -2.472156 1.288456
H 0.288332 0.629545 1.587504
H -3.856978 0.153538 2.145248
H -2.597900 1.571646 -1.519825
H -3.338264 -0.997757 -2.005603
H 3.010494 -2.144425 2.252516
H 1.879156 -1.832553 -1.941957
H 1.441773 2.800599 1.189354
H -6.338201 0.186118 1.839022
H -1.440637 3.750402 -1.928888
H -5.829071 -0.963710 -2.321535
H 2.939803 0.390930 -2.048984
H 0.574769 4.388782 -0.568304
H -7.339689 -0.372747 -0.400612
H 5.672270 0.966407 3.522091
H 6.190605 -0.125811 2.179546
H 5.588895 1.539439 1.804796
H 2.978387 2.655775 -1.432191
H 4.496901 3.470523 -0.887179
H 4.590560 2.040969 -1.984453


