%chk=000195459.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195459

0 1
O -2.339554 -0.145727 1.004940
O -2.829007 2.958910 1.050269
O -4.668582 1.888074 -0.283630
O -2.841573 -2.406363 -0.406753
O 0.617856 2.696903 -0.383746
O 3.566149 -1.888252 -0.878489
N -0.234062 0.589368 0.252223
N 1.890440 0.699380 -0.627647
N -0.278269 -1.911858 0.639443
N 1.763324 -3.056743 -0.045311
N -0.147859 -4.306083 0.606192
C -1.493388 1.001617 0.925347
C -2.246061 2.074133 0.090243
C -3.418788 1.311358 -0.597621
C -3.341774 -0.140153 -0.053456
C 0.314389 -0.712307 0.240904
C -2.937701 -1.157552 -1.124484
C 0.801210 1.506226 -0.241424
C 1.612400 -0.650775 -0.269414
C 3.259727 1.207610 -0.873325
C 2.437088 -1.856439 -0.448846
C 3.939825 1.687043 0.418410
C 0.517376 -3.078749 0.397524
C 5.362148 2.155915 0.132923
H -1.308396 1.302479 1.986212
H -1.595457 2.629792 -0.620167
H -3.374257 1.366598 -1.706984
H -4.268264 -0.454172 0.481219
H -1.957463 -0.928695 -1.581921
H -3.713020 -1.248990 -1.907902
H -2.654107 3.895692 0.796992
H 3.849245 0.376734 -1.341762
H 3.186990 2.036495 -1.614249
H -4.661734 2.252261 0.649198
H -1.308071 -1.945467 0.821603
H 3.352931 2.508607 0.876263
H 3.955878 0.865493 1.163494
H -2.581840 -3.126469 -1.023811
H 5.979147 1.348802 -0.282928
H 5.383666 2.989930 -0.578192
H 5.854503 2.498067 1.051336
H 0.461028 -5.125709 0.561479
H -0.802491 -4.351784 1.379348


%chk=000195459-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195459

0 1
O -2.351440 -0.248135 0.960129
O -2.259666 3.142081 -0.330397
O -4.449312 2.007909 0.698277
O -3.012901 -2.510806 -0.364111
O 0.500720 2.792111 -0.122247
O 3.821262 -1.615008 -0.637336
N -0.223191 0.545733 0.268608
N 1.939372 0.848403 -0.263054
N -0.198523 -1.954667 0.397250
N 1.965872 -2.954208 -0.042154
N 0.099440 -4.293659 0.446515
C -1.581483 0.951109 0.662104
C -2.315412 1.705418 -0.486597
C -3.781683 1.221941 -0.327054
C -3.624482 -0.228479 0.175127
C 0.376110 -0.709631 0.231336
C -3.526366 -1.258804 -0.959422
C 0.750010 1.538684 -0.047816
C 1.720636 -0.546447 -0.093063
C 3.224439 1.502366 -0.583658
C 2.601501 -1.700621 -0.288885
C 4.180439 1.561076 0.627684
C 0.673605 -3.046397 0.260413
C 5.503558 2.260677 0.253114
H -1.524042 1.593340 1.562252
H -1.898765 1.382938 -1.462703
H -4.335578 1.278383 -1.286738
H -4.425865 -0.492886 0.882978
H -2.837660 -0.908858 -1.756838
H -4.533373 -1.417777 -1.394502
H -1.280216 3.376521 -0.257738
H 3.701964 0.934467 -1.400556
H 2.980148 2.520566 -0.936786
H -4.041117 2.918505 0.660819
H -1.227984 -2.054456 0.459698
H 3.685899 2.097917 1.460150
H 4.386642 0.528042 0.962255
H -3.044155 -3.231747 -1.041325
H 6.022910 1.714864 -0.556266
H 5.330030 3.298677 -0.088647
H 6.185494 2.301154 1.120973
H 0.727823 -5.089802 0.364617
H -0.801062 -4.405292 0.907092


