%chk=000245755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245755

0 1
O -0.944066 -0.852447 0.191232
O -0.599159 -0.613670 -2.056077
O 6.135134 -0.553569 0.154833
O 5.487362 0.806332 1.707625
N -1.422683 2.026389 -0.185451
N 5.276388 0.059464 0.766596
C -2.514983 1.407605 -1.010509
C -3.109873 0.182139 -0.366107
C -0.784371 3.155178 -0.947739
C -1.951953 2.495088 1.140958
C -2.348282 -0.898790 0.104787
C -2.925964 -2.066985 0.646787
C -4.508328 0.075649 -0.270712
C 0.129734 2.605983 -2.042541
C -0.793121 2.744996 2.106954
C -4.322906 -2.130452 0.722263
C -5.105405 -1.065479 0.266077
C -2.081472 -3.199862 1.121787
C -0.172130 -0.616784 -0.929816
C 1.241396 -0.447941 -0.473076
C 2.262243 -1.119166 -1.162028
C 1.526989 0.390187 0.611596
C 3.587143 -0.955384 -0.756436
C 2.850655 0.560881 1.021226
C 3.866615 -0.116520 0.332971
H -2.058126 1.093941 -1.989396
H -3.317379 2.136230 -1.265342
H -1.533152 3.848867 -1.388842
H -0.178747 3.760298 -0.236411
H -2.586103 3.403038 1.056415
H -2.601861 1.691507 1.558262
H -5.135266 0.893644 -0.623353
H 0.991253 2.078037 -1.616028
H -0.388125 1.882997 -2.690365
H 0.510576 3.411321 -2.678656
H -0.084653 1.898053 2.088646
H -0.228820 3.648993 1.853367
H -1.155831 2.853357 3.134654
H -4.800458 -3.017608 1.135396
H -6.191266 -1.128812 0.329292
H -1.025049 -2.909057 1.233028
H -2.415778 -3.578887 2.097089
H -2.114716 -4.039489 0.411727
H 2.020957 -1.759553 -2.014641
H 0.699683 0.915620 1.126580
H 4.403976 -1.468765 -1.276039
H 3.100423 1.211027 1.866818


%chk=000245755-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245755

0 1
O -1.004099 -0.897797 0.402192
O -0.532256 -0.734266 -1.890388
O 6.226192 0.218747 -0.086158
O 5.644434 0.088897 2.116143
N -1.323721 1.937872 -0.365424
N 5.355516 0.079063 0.857332
C -2.480214 1.329589 -1.078016
C -3.131177 0.138266 -0.383784
C -0.736633 3.067972 -1.145519
C -1.690725 2.356508 1.020089
C -2.425649 -0.927074 0.233533
C -3.068864 -2.038669 0.837663
C -4.546618 0.044448 -0.397280
C -0.234611 2.688488 -2.550924
C -0.494056 2.819802 1.870992
C -4.481780 -2.084198 0.797355
C -5.220180 -1.051540 0.178742
C -2.256923 -3.138659 1.492153
C -0.161130 -0.654346 -0.697255
C 1.251718 -0.446643 -0.253182
C 2.245657 -0.297255 -1.255483
C 1.618360 -0.427376 1.117859
C 3.594459 -0.121468 -0.900448
C 2.964615 -0.257198 1.488194
C 3.932953 -0.103688 0.471048
H -2.116238 0.981258 -2.062283
H -3.276577 2.093530 -1.267382
H -1.477084 3.906459 -1.231164
H 0.118320 3.454875 -0.565037
H -2.465906 3.165559 0.992066
H -2.160350 1.486613 1.511512
H -5.119939 0.853131 -0.866021
H 0.432901 1.811913 -2.504060
H -1.055069 2.455641 -3.251318
H 0.331692 3.536821 -2.976961
H 0.322219 2.078125 1.824223
H -0.093150 3.796928 1.549605
H -0.807500 2.925198 2.925697
H -4.999326 -2.936087 1.252684
H -6.314021 -1.097368 0.153081
H -1.646573 -2.747757 2.326798
H -2.916226 -3.930225 1.886115
H -1.552832 -3.598661 0.774959
H 1.939694 -0.332704 -2.305768
H 0.842341 -0.549922 1.876970
H 4.380386 -0.004261 -1.650623
H 3.278472 -0.240942 2.534874


