%chk=000292116.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292116

0 1
O 0.129862 -1.351017 0.875293
O 0.370480 1.637383 1.854797
O 1.261638 0.675555 -1.458646
O 3.759309 -1.347129 0.733330
O 0.665012 3.661636 0.885531
O 3.484618 1.036634 -1.702804
O 4.091829 0.681254 1.675070
O -5.939947 -1.401202 -0.427669
N -1.805127 -0.433676 -0.084140
N -2.732519 -0.899041 -2.121465
N -3.749591 -0.910738 1.404942
N -5.524226 -1.658813 -2.646076
C 0.087696 1.039996 0.571455
C 1.403156 0.498301 -0.024360
C -0.752777 -0.219676 0.920853
C 1.415078 -1.014306 0.276470
C 2.445316 -1.426719 1.337264
C -3.157851 -0.777519 0.148137
C -1.606180 -0.550821 -1.507691
C -3.715286 -1.037678 -1.121951
C 0.716184 2.994538 1.884769
C 2.391671 0.984484 -2.208842
C 4.496714 -0.186672 0.936221
C 1.103595 3.333822 3.273816
C 1.970463 1.193986 -3.615442
C -5.123053 -1.375535 -1.351551
C 5.729103 -0.251788 0.117339
H -0.415046 1.776940 -0.096499
H 2.303895 1.046018 0.343079
H -1.168335 -0.216765 1.957617
H 1.495033 -1.626668 -0.648282
H 2.347493 -2.496803 1.602326
H 2.390222 -0.803479 2.250108
H -0.639913 -0.351276 -1.955253
H -4.760852 -1.123069 1.346577
H -3.547406 -0.191709 2.086045
H 0.700191 2.625640 4.016452
H 0.773240 4.349388 3.544637
H 2.205140 3.306294 3.381368
H 0.892077 1.019472 -3.773206
H 2.521552 0.526405 -4.298589
H 2.182417 2.229703 -3.934962
H 6.011564 -1.281105 -0.152611
H 6.579171 0.225418 0.627278
H 5.562407 0.297694 -0.834160
H -6.483139 -1.897570 -2.836056
H -4.879678 -1.648185 -3.420717


%chk=000292116-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292116

0 1
O -0.162052 -1.053789 1.062948
O 0.458597 1.774403 1.899547
O 0.971485 0.560152 -1.551134
O 3.572275 -1.140702 1.138762
O 1.281987 3.685419 0.843813
O 3.267922 0.373755 -1.916259
O 3.925521 1.066395 1.814768
O -5.322571 -2.629487 -0.723463
N -1.958069 -0.054281 -0.215096
N -3.292265 0.186834 -2.044357
N -3.079024 -1.916727 0.938148
N -5.608887 -1.404585 -2.704262
C 0.028198 1.286697 0.568111
C 1.231532 0.575418 -0.090230
C -0.981781 0.164538 0.852330
C 1.205294 -0.857551 0.493879
C 2.183315 -1.090302 1.661336
C -2.957299 -1.034698 -0.108497
C -2.207374 0.654132 -1.424532
C -3.779032 -0.868749 -1.239505
C 1.170627 3.006909 1.884246
C 2.110959 0.470222 -2.378311
C 4.337965 0.033201 1.235715
C 1.760431 3.286965 3.238560
C 1.712504 0.534069 -3.831974
C -4.949769 -1.695191 -1.526974
C 5.653108 -0.135439 0.522547
H -0.341337 2.126495 -0.040695
H 2.176857 1.105744 0.099092
H -1.514960 0.324712 1.806152
H 1.368860 -1.606312 -0.300920
H 2.001686 -2.081350 2.103479
H 2.085278 -0.299196 2.422957
H -1.552344 1.437541 -1.791206
H -3.891022 -2.541267 0.842314
H -2.252517 -2.211800 1.457566
H 1.113865 2.906558 4.044393
H 1.936320 4.366239 3.357399
H 2.730853 2.758336 3.292841
H 0.726492 0.070962 -3.991422
H 2.477902 0.040593 -4.449330
H 1.645020 1.592323 -4.144995
H 6.050660 -1.153541 0.656664
H 6.374586 0.614492 0.878279
H 5.471698 0.020262 -0.557216
H -6.435426 -1.938970 -2.961926
H -5.260869 -0.647826 -3.293740


