%chk=000212839.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212839

0 1
O 1.338944 -2.807553 1.343146
O -1.370508 -2.753824 1.430337
N 3.466423 0.196957 -0.441919
N -3.538399 0.210688 -0.367146
C 3.177029 0.778352 0.910833
C 4.943943 0.152945 -0.709146
C -3.223563 1.019646 0.857828
C -5.021514 0.129043 -0.590636
C 3.737765 2.207240 0.995414
C 5.524479 1.575720 -0.649200
C -3.775964 2.445487 0.699267
C -5.598291 1.543156 -0.772544
C 5.244012 2.229901 0.709066
C -5.287841 2.426642 0.442076
C 2.885788 -1.180272 -0.573342
C -2.965282 -1.172991 -0.247445
C 1.382913 -1.143076 -0.474203
C -1.460871 -1.134700 -0.317353
C 0.710432 -1.954719 0.450510
C -0.699101 -1.957349 0.531261
C 0.614172 -0.318984 -1.309178
C -0.779020 -0.317682 -1.231604
H 3.582934 0.161370 1.740101
H 2.070923 0.807818 1.035485
H 5.092871 -0.262485 -1.729537
H 5.490754 -0.507294 -0.002481
H -2.116434 1.057443 0.960230
H -3.618664 0.559273 1.788553
H -5.553084 -0.392352 0.234131
H -5.193224 -0.461590 -1.516453
H 3.524931 2.630976 1.993311
H 3.209896 2.850603 0.262325
H 5.074315 2.188772 -1.456365
H 6.610560 1.542906 -0.848591
H -3.261148 2.945500 -0.145597
H -3.543034 3.036796 1.602700
H -6.688400 1.481335 -0.939593
H -5.164567 2.000417 -1.684645
H 5.617755 3.270428 0.715359
H 5.793695 1.700718 1.509787
H -5.821622 2.049568 1.334552
H -5.659030 3.453683 0.271571
H 3.302209 -1.905902 0.170624
H 3.164245 -1.570728 -1.582117
H -3.336512 -1.781480 -1.106082
H -3.291312 -1.704348 0.678445
H 1.126301 0.336366 -2.016581
H -1.365642 0.337206 -1.882412
H 2.329638 -2.720998 1.265698
H -0.723204 -3.281232 1.977461


%chk=000212839-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212839

0 1
O 1.329341 -3.150172 1.117878
O -1.323400 -3.067735 1.306582
N 3.532968 0.191837 -0.371300
N -3.621009 0.204223 -0.235753
C 3.402219 0.708947 1.014921
C 4.940218 0.216509 -0.845509
C -3.422630 1.135771 0.904674
C -5.055210 0.088164 -0.598902
C 3.939298 2.149350 1.123435
C 5.515400 1.646150 -0.792545
C -3.955130 2.543522 0.569255
C -5.639737 1.462344 -0.984548
C 5.402703 2.228417 0.634276
C -5.445079 2.482220 0.161090
C 2.910515 -1.136567 -0.542618
C -2.994298 -1.117127 0.007177
C 1.396646 -1.114795 -0.362156
C -1.474909 -1.086116 -0.107180
C 0.715523 -2.084315 0.405289
C -0.698598 -2.074085 0.533979
C 0.609437 -0.123552 -1.005535
C -0.793496 -0.111816 -0.881072
H 3.961952 0.051418 1.734914
H 2.334999 0.674828 1.296839
H 4.963841 -0.167044 -1.883401
H 5.588225 -0.459695 -0.224598
H -2.342846 1.177916 1.135078
H -3.943392 0.753288 1.823271
H -5.656730 -0.338462 0.248639
H -5.142875 -0.614141 -1.449631
H 3.857472 2.491580 2.172856
H 3.304326 2.812089 0.504437
H 4.948410 2.283589 -1.498126
H 6.570301 1.629198 -1.127744
H -3.358769 2.960588 -0.265632
H -3.816619 3.207720 1.444306
H -6.713462 1.350312 -1.230937
H -5.121304 1.824909 -1.893407
H 5.764561 3.273660 0.655365
H 6.052469 1.646902 1.321212
H -6.052253 2.170434 1.036556
H -5.807731 3.482431 -0.143700
H 3.386042 -1.892408 0.152815
H 3.154119 -1.486705 -1.565715
H -3.391492 -1.822750 -0.750673
H -3.275368 -1.545061 0.999560
H 1.129091 0.645070 -1.586784
H -1.402360 0.652154 -1.375194
H 2.315001 -3.100838 1.049727
H -0.615681 -3.654761 1.684428


