%chk=000121448.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000121448

2 1
O 1.654050 -0.736494 0.542906
O -0.428740 -3.095687 -1.057293
O 6.104345 0.557237 -0.507359
O -2.501217 -3.283554 -0.285319
O -4.643479 -2.771173 1.144071
N -0.491135 -0.429270 -0.157464
N 0.295201 2.119729 -0.967590
N 5.519676 -0.694798 1.891171
N -6.844462 -1.616608 2.306574
N 6.256263 -0.927877 2.694042
N -7.754411 -2.182019 2.612377
C 1.292000 1.029614 -1.112543
C 2.746510 1.460565 -0.819522
C -1.004118 -1.534627 0.664761
C -2.150977 -1.104388 1.596415
C 0.867144 -0.103562 -0.149585
C 3.778128 0.421225 -1.293378
C -3.446298 -0.660122 0.901215
C 0.124696 2.943672 -2.210628
C -1.423106 -2.700308 -0.246575
C 4.844500 0.187738 -0.277646
C -4.627769 -1.474564 1.334233
C -0.668086 4.179470 -1.878526
C 4.601731 -0.429168 0.938495
C -5.750278 -0.911873 1.942319
C -0.371159 5.382019 -2.363246
H 1.230680 0.608639 -2.157833
H 2.944917 2.432791 -1.322688
H 2.857312 1.665762 0.267146
H -0.145427 -1.929692 1.310857
H -1.778894 -0.268160 2.237623
H -2.347256 -1.928043 2.320216
H -1.167545 0.183904 -0.621874
H 3.267051 -0.559156 -1.500682
H 4.196911 0.722084 -2.280766
H 0.528084 2.727803 -0.170376
H -3.360612 -0.724463 -0.212337
H -3.614794 0.428853 1.086827
H 1.092222 3.205425 -2.694144
H -0.445275 2.333554 -2.952927
H -1.531581 4.015277 -1.230999
H 3.535464 -0.750680 1.150925
H -0.684993 -3.886870 -1.644599
H -5.778257 0.177793 2.148999
H 6.272268 1.010559 -1.400912
H -3.773536 -3.166455 0.620000
H -0.962720 6.267199 -2.149335
H 0.465174 5.594600 -3.016928


%chk=000121448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121448

2 1
O 1.745555 -1.016430 0.355507
O -0.920064 -2.746911 -1.698025
O 6.187748 0.845729 0.032555
O -2.851431 -3.024055 -0.501204
O -4.719679 -2.476581 1.067599
N -0.424887 -0.409253 -0.236112
N 0.321206 1.959979 -1.213506
N 5.487186 -0.835417 2.042889
N -6.696823 -1.486380 2.622464
N 6.221729 -1.083834 2.909131
N -7.643267 -2.131292 2.814745
C 1.399699 0.951578 -1.137172
C 2.790487 1.483677 -0.671995
C -1.049835 -1.564794 0.410405
C -1.990825 -1.225150 1.595994
C 0.939682 -0.243437 -0.259513
C 3.978524 0.542697 -1.120751
C -3.318216 -0.450467 1.260218
C 0.283157 2.806811 -2.450993
C -1.707966 -2.494299 -0.621993
C 4.958924 0.271152 -0.013198
C -4.567372 -1.254847 1.572144
C -0.930752 3.709761 -2.434785
C 4.612218 -0.580823 1.042884
C -5.587885 -0.738290 2.393809
C -0.871373 5.061964 -2.514549
H 1.511323 0.542203 -2.163931
H 2.948038 2.486216 -1.107515
H 2.784064 1.601272 0.426822
H -0.195733 -2.146098 0.826551
H -1.401469 -0.615320 2.300487
H -2.219424 -2.166234 2.129700
H -0.936003 0.345374 -0.728954
H 3.563142 -0.429120 -1.438746
H 4.502647 0.977114 -1.992268
H 0.259529 2.545423 -0.366215
H -3.362587 -0.183749 0.183835
H -3.353985 0.501930 1.811964
H 1.201862 3.420801 -2.572073
H 0.230817 2.114602 -3.315207
H -1.905206 3.204250 -2.381162
H 3.613174 -1.041897 1.075037
H -1.336254 -3.391850 -2.336744
H -5.559470 0.240555 2.873293
H 6.418118 1.419213 -0.744483
H -3.934097 -2.783812 0.418850
H -1.778607 5.674744 -2.530848
H 0.082584 5.599197 -2.586843


