%chk=000205795.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205795

0 1
O -1.307042 0.996895 0.433579
O 4.387958 -1.348033 -0.094754
O 5.055056 0.759694 0.391885
N -4.664011 -0.426535 0.185342
N 0.421240 -0.549567 0.045482
C -3.612217 0.628107 0.314632
C -5.087422 -0.936301 1.533068
C -5.834804 0.041402 -0.626582
C -2.269034 -0.092086 0.141067
C -5.736434 -2.312876 1.385189
C -5.444162 0.142501 -2.101297
C 0.010285 0.718381 0.369083
C 0.893113 1.792980 0.651303
C 2.702886 0.233572 0.262075
C 2.251251 1.531868 0.592910
C 1.755866 -0.775957 -0.004141
C 4.148435 -0.021803 0.204758
C 5.781445 -1.775446 -0.224773
C 6.324835 -1.350372 -1.572673
H -3.631562 1.175516 1.281553
H -3.718155 1.408415 -0.470904
H -5.776773 -0.240895 2.058855
H -4.181513 -1.030447 2.173329
H -6.648340 -0.712226 -0.516810
H -6.248074 1.009161 -0.269572
H -2.092101 -0.451461 -0.885247
H -2.101344 -0.908270 0.861625
H -5.898458 -2.778066 2.362876
H -5.098705 -2.984663 0.793327
H -6.703489 -2.260184 0.872420
H -6.323284 0.319607 -2.729270
H -4.967551 -0.786699 -2.443852
H -4.730743 0.953179 -2.286624
H 0.494337 2.772549 0.900379
H 2.986667 2.317327 0.799407
H 2.074056 -1.797794 -0.265295
H 5.670823 -2.870312 -0.122252
H 6.358178 -1.354979 0.618537
H 7.312237 -1.786210 -1.763607
H 5.659121 -1.653861 -2.390705
H 6.430132 -0.256012 -1.629820


%chk=000205795-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205795

0 1
O -1.320546 1.163202 0.387079
O 4.423931 -1.391026 -0.041384
O 5.094541 0.800333 0.423254
N -4.725183 -0.365370 0.158177
N 0.392862 -0.436129 0.075026
C -3.690105 0.689232 0.292546
C -5.004387 -1.062460 1.443535
C -5.952733 0.088203 -0.546555
C -2.298688 0.066352 0.125166
C -5.518739 -2.501604 1.249965
C -5.747381 0.252257 -2.064432
C 0.020693 0.845025 0.341930
C 0.943060 1.903162 0.584277
C 2.726374 0.263744 0.269184
C 2.308173 1.598757 0.545767
C 1.726510 -0.712603 0.041480
C 4.178799 -0.040783 0.230581
C 5.858940 -1.799565 -0.128869
C 6.404204 -1.565155 -1.540494
H -3.744762 1.220231 1.271835
H -3.833839 1.453100 -0.491416
H -5.727217 -0.481612 2.071059
H -4.059368 -1.102246 2.017134
H -6.734062 -0.675380 -0.379894
H -6.346074 1.042724 -0.112566
H -2.149104 -0.324597 -0.895471
H -2.116094 -0.756252 0.838918
H -5.677199 -2.989897 2.229737
H -4.785299 -3.091241 0.673103
H -6.479916 -2.528131 0.705138
H -6.690377 0.566579 -2.549755
H -5.420656 -0.703824 -2.508945
H -4.982480 1.015383 -2.297943
H 0.571109 2.909121 0.791403
H 3.070088 2.364169 0.723278
H 2.005574 -1.747562 -0.174852
H 5.839478 -2.868850 0.136094
H 6.432647 -1.229046 0.622425
H 7.438619 -1.950354 -1.609457
H 5.789766 -2.089238 -2.292781
H 6.421541 -0.488549 -1.778774


