%chk=000271703.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271703

0 1
O -2.833613 3.041718 -0.451566
O -0.689251 2.965620 -0.233635
O -4.709403 -2.774456 0.317624
O -5.589166 -0.844240 -0.110598
N 1.630204 -0.056110 0.512569
N 0.537575 0.736240 0.197236
N -1.802957 2.426249 -0.256842
N -4.636396 -1.572460 0.116634
C 3.936857 -0.553919 0.793601
C 4.690856 -1.069982 -0.440385
C 2.843902 0.412669 0.397983
C 5.817638 -2.031727 -0.038098
C 3.274656 1.774451 -0.090316
C 6.572056 -2.550655 -1.259224
C 2.690055 2.919360 0.730950
C -0.715822 0.174703 0.209032
C -1.872219 0.994130 -0.038356
C -0.916497 -1.230503 0.441231
C -3.155404 0.401400 -0.067332
C -3.304682 -0.958979 0.149950
C -2.166562 -1.782233 0.412417
H 4.631464 -0.050131 1.497621
H 3.516174 -1.415633 1.359956
H 5.109001 -0.225127 -1.020558
H 3.983379 -1.584374 -1.121616
H 6.523028 -1.524271 0.649089
H 5.400359 -2.885297 0.532633
H 4.384110 1.850634 -0.082797
H 2.992733 1.886912 -1.161024
H 7.036079 -1.736812 -1.828055
H 5.910856 -3.094119 -1.944502
H 7.372477 -3.240217 -0.965422
H 2.797861 2.750427 1.809507
H 1.619029 3.086708 0.524076
H 3.197472 3.866212 0.500618
H 0.651426 1.776387 0.036507
H -0.035725 -1.850633 0.644683
H -4.038967 1.036593 -0.263910
H -2.326584 -2.854837 0.587019


%chk=000271703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271703

0 1
O -2.829863 3.010942 -0.993505
O -0.571995 2.856805 -0.734133
O -4.937702 -2.663845 0.667818
O -5.774989 -0.663272 -0.054859
N 1.573625 -0.196525 0.430460
N 0.500092 0.625178 0.067864
N -1.781521 2.334117 -0.678591
N -4.794706 -1.436288 0.281066
C 3.929014 -0.580805 0.738941
C 4.759802 -1.062154 -0.485695
C 2.784042 0.331633 0.355020
C 5.951927 -1.954208 -0.068326
C 3.100005 1.763753 -0.058306
C 6.778438 -2.441735 -1.277297
C 2.886367 2.771994 1.109159
C -0.781219 0.133087 0.116513
C -1.922243 0.947282 -0.244210
C -1.034083 -1.217259 0.533260
C -3.234816 0.428543 -0.189589
C -3.426555 -0.894070 0.222813
C -2.327594 -1.725312 0.587057
H 4.604931 -0.042846 1.435783
H 3.524348 -1.458861 1.273378
H 5.141246 -0.189866 -1.054810
H 4.096809 -1.624222 -1.172231
H 6.605252 -1.389003 0.627235
H 5.572130 -2.827419 0.499366
H 4.153274 1.812386 -0.385490
H 2.491694 2.076871 -0.930816
H 7.195196 -1.588453 -1.844971
H 6.154237 -3.034067 -1.972303
H 7.622933 -3.078357 -0.956659
H 3.521058 2.513551 1.975317
H 1.836563 2.790119 1.450927
H 3.151040 3.792358 0.781988
H 0.586524 1.611873 -0.247321
H -0.169170 -1.824696 0.804792
H -4.083312 1.059258 -0.466625
H -2.524780 -2.752791 0.903680


