%chk=000286871.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286871

0 1
O 0.791728 -2.803942 0.471024
O -3.128371 1.758174 2.744237
O 3.315350 -0.942603 -3.373600
O -5.337190 1.881169 0.945573
O 4.560937 1.395529 -2.310965
O 2.166331 2.142777 1.944439
O 0.787435 0.530434 2.275865
N -0.984119 -2.057066 -1.573360
N 1.632634 1.099774 1.591258
C 0.354991 -1.454503 0.364441
C -0.939980 -1.342677 -0.441234
C -2.029836 -0.523522 0.003086
C 1.458551 -0.615736 -0.279497
C -3.177882 -0.440809 -0.834045
C 2.029631 0.530938 0.299102
C -2.014003 0.197015 1.236620
C 1.944740 -1.045306 -1.523732
C -4.269567 0.396651 -0.450015
C -3.203501 -1.202819 -2.037373
C -3.062772 1.003242 1.592898
C 2.976922 -0.373046 -2.185734
C -4.224747 1.114943 0.725487
C 3.073303 1.231211 -0.362595
C 3.550410 0.794880 -1.583352
C -2.117032 -1.992066 -2.358671
C -2.014383 1.650187 3.672846
C 4.375267 -0.335282 -4.163193
C -5.411372 2.671671 2.160725
C 5.178678 2.576459 -1.738449
H 0.190027 -1.188144 1.447279
H -1.145479 0.078981 1.892672
H 1.502648 -1.924468 -2.012145
H -5.146065 0.469420 -1.093529
H -4.077093 -1.155975 -2.683889
H 3.487904 2.123478 0.121644
H -2.086332 -2.609181 -3.262790
H 0.767514 -3.262699 -0.406808
H -2.005293 0.653021 4.122813
H -2.264478 2.421650 4.409874
H -1.061348 1.870670 3.174918
H 4.094469 0.685311 -4.444699
H 4.410996 -1.003108 -5.032485
H 5.315163 -0.347831 -3.600875
H -6.387633 3.157510 2.049526
H -4.594427 3.401206 2.184792
H -5.380835 2.016142 3.037695
H 4.441837 3.377968 -1.629191
H 5.922463 2.827615 -2.505952
H 5.662911 2.331658 -0.788236


%chk=000286871-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286871

0 1
O 0.977124 -3.102165 0.251310
O -2.731924 2.337633 2.071452
O 2.744018 -0.252417 -3.482261
O -5.082025 2.141998 0.458480
O 4.489790 1.561127 -1.981420
O 3.002750 0.973555 2.756154
O 0.912883 0.079929 2.682726
N -1.118434 -2.695079 -1.157296
N 2.034453 0.411230 2.103569
C 0.406537 -1.777521 0.472601
C -0.953485 -1.702571 -0.255654
C -1.952966 -0.699763 -0.014554
C 1.404094 -0.735266 -0.084988
C -3.164592 -0.761121 -0.805855
C 2.197685 0.180365 0.664909
C -1.807483 0.333893 0.962595
C 1.673891 -0.807235 -1.467229
C -4.184854 0.210428 -0.580440
C -3.299017 -1.815676 -1.766347
C -2.817957 1.280592 1.160365
C 2.657461 -0.031300 -2.116229
C -4.042133 1.213831 0.380817
C 3.230362 0.939027 0.052113
C 3.475649 0.849742 -1.323935
C -2.275996 -2.752791 -1.904726
C -1.490970 2.459339 2.854016
C 3.513607 0.619136 -4.395076
C -5.528375 2.657183 1.771978
C 5.356389 2.413542 -1.158291
H 0.270148 -1.636869 1.555472
H -0.893978 0.368165 1.563708
H 1.107104 -1.507277 -2.088230
H -5.115132 0.184055 -1.156547
H -4.203446 -1.890139 -2.378704
H 3.826784 1.586057 0.698480
H -2.345582 -3.580869 -2.616113
H 0.408395 -3.482966 -0.498713
H -1.311959 1.559728 3.469645
H -1.646307 3.337511 3.497043
H -0.622964 2.623009 2.189057
H 3.215957 1.674251 -4.277185
H 3.244246 0.251737 -5.396761
H 4.595349 0.517876 -4.218503
H -6.479501 3.166718 1.554315
H -4.791830 3.358041 2.192076
H -5.698426 1.824790 2.479513
H 4.777161 3.223028 -0.674588
H 6.083545 2.844137 -1.861672
H 5.883058 1.818273 -0.388677


