%chk=000235142.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235142

0 1
O -0.005344 -1.795921 0.038133
O -3.434960 -1.680035 -0.752271
O 3.423830 -1.662323 0.825268
O -4.042865 -0.045062 0.744053
O 4.047050 -0.115801 -0.756338
N -5.229048 -0.414195 -1.237819
N 5.226015 -0.384767 1.245887
C -6.307772 0.591566 -0.993829
C 6.313731 0.596919 0.949348
C -6.405482 1.510194 -2.214339
C -7.629996 -0.131580 -0.721852
C 6.420049 1.577531 2.119878
C 7.629375 -0.151271 0.715892
C -1.211433 -0.996857 -0.020162
C 1.206404 -1.003451 0.053474
C -2.319326 -2.043809 0.107649
C 2.306842 -2.063666 -0.015994
C -4.240746 -0.635537 -0.299282
C 4.238312 -0.649980 0.318107
H -6.015884 1.194191 -0.087663
H 6.026898 1.153606 0.012697
H -7.146841 2.300872 -2.048018
H -5.446304 2.001208 -2.424417
H -6.702502 0.973187 -3.121989
H -8.432385 0.585448 -0.512053
H -7.955270 -0.744239 -1.569662
H -7.551245 -0.794937 0.149209
H 5.465262 2.087192 2.303968
H 7.168113 2.351929 1.912128
H 6.712955 1.086431 3.054466
H 8.438122 0.546572 0.469087
H 7.949318 -0.721655 1.594657
H 7.544499 -0.858518 -0.119325
H -5.292933 -1.007303 -2.060542
H 5.284111 -0.933144 2.099506
H -1.256820 -0.471077 -0.991089
H -1.222614 -0.264533 0.805891
H 1.255258 -0.425588 0.994167
H 1.222976 -0.317591 -0.811450
H -2.014312 -3.019962 -0.320703
H -2.679240 -2.162904 1.143548
H 1.994086 -3.013220 0.463527
H 2.667413 -2.240722 -1.043346


%chk=000235142-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235142

0 1
O -0.005869 -1.805457 0.035224
O -3.325410 -1.295730 -1.543104
O 3.317984 -1.244319 1.586103
O -4.276274 -0.739674 0.553510
O 4.277278 -0.797069 -0.532592
N -5.256117 -0.095862 -1.483939
N 5.256432 -0.060624 1.473487
C -6.442108 0.569575 -0.898746
C 6.448756 0.566290 0.859515
C -6.915186 1.688841 -1.847538
C -7.563619 -0.451454 -0.592874
C 6.925034 1.731114 1.750074
C 7.565299 -0.476112 0.612972
C -1.126535 -0.996712 -0.454792
C 1.120569 -0.981770 0.485527
C -2.225241 -1.994098 -0.838792
C 2.213926 -1.967180 0.913186
C -4.303277 -0.703039 -0.705182
C 4.301576 -0.699233 0.722887
H -6.106870 1.012130 0.057516
H 6.120260 0.959815 -0.120194
H -7.782772 2.214195 -1.411980
H -6.114026 2.427982 -2.025091
H -7.233034 1.274488 -2.824295
H -8.416574 0.048041 -0.097860
H -7.931094 -0.923663 -1.523107
H -7.188067 -1.241204 0.080244
H 6.126640 2.481687 1.887679
H 7.795488 2.230045 1.289746
H 7.239660 1.366201 2.747409
H 8.422605 -0.009385 0.094099
H 7.927311 -0.899255 1.568602
H 7.186872 -1.299115 -0.017370
H -5.170821 -0.182970 -2.497932
H 5.168038 -0.096886 2.490297
H -0.818659 -0.402867 -1.342402
H -1.489625 -0.307461 0.335946
H 0.818279 -0.345694 1.345334
H 1.485857 -0.331884 -0.336931
H -1.843609 -2.728885 -1.564259
H -2.616661 -2.502190 0.058593
H 1.828126 -2.667135 1.670232
H 2.602758 -2.516283 0.039193


