%chk=000250903.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250903

0 1
O 0.412604 0.764135 -1.985920
O -0.079903 -1.977471 0.044279
O 2.333900 -1.477077 -0.799431
O 3.314756 2.482535 -0.649399
O 0.931366 -2.237213 2.056880
O 4.418987 -0.738319 -0.300467
O -5.720082 2.249028 0.945229
O -4.476980 -2.109803 1.674017
O 3.173057 1.844774 1.512668
N -1.634356 0.809205 -0.849086
N -3.013059 -0.852432 0.450747
N -3.040318 2.609141 -0.657200
N -5.078607 0.099980 1.288417
C 0.260583 -0.580854 0.017864
C 1.748959 -0.270521 -0.253196
C -0.491493 -0.046616 -1.238019
C 1.723295 0.824910 -1.341092
C 1.896184 2.252957 -0.809561
C -2.742284 0.392127 -0.105396
C -1.880095 2.196130 -1.166786
C -3.601894 1.511494 0.010725
C 0.317905 -2.739460 1.156380
C 3.715960 -1.619222 -0.728734
C -4.858585 1.436956 0.731770
C -4.237645 -1.023733 1.186411
C -0.187560 -4.117739 0.953646
C 3.877870 2.174402 0.588566
C 4.070696 -2.956059 -1.266864
C 5.348357 2.312090 0.492524
H -0.061101 -0.117898 0.981747
H 2.308930 0.021430 0.672652
H -0.833459 -0.859897 -1.929752
H 2.435999 0.611393 -2.171464
H 1.359796 2.442510 0.138710
H 1.602449 3.004876 -1.568053
H -1.174704 2.761494 -1.760313
H -2.372128 -1.644822 0.345653
H -5.952861 -0.038158 1.821273
H -0.494932 -4.316657 -0.086530
H -1.064717 -4.314363 1.597608
H 0.578992 -4.862531 1.227413
H 3.204464 -3.485952 -1.697397
H 4.491934 -3.596371 -0.472749
H 4.839271 -2.872961 -2.053651
H 5.779471 2.695859 1.430210
H 5.796609 1.313693 0.306191
H 5.666068 2.966712 -0.334219


%chk=000250903-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250903

0 1
O 0.378144 1.347875 -1.582195
O -0.206066 -1.572062 0.508534
O 2.080846 -1.360497 -0.987995
O 3.774380 2.440600 -0.526795
O 1.212937 -1.699218 2.353098
O 4.348347 -0.852582 -0.796973
O -6.338082 1.401797 0.307492
O -4.283684 -2.733333 1.182551
O 3.794157 1.617091 1.657803
N -1.783633 0.904234 -0.742913
N -2.979892 -1.071353 0.186593
N -3.520203 2.396586 -0.749688
N -5.249543 -0.641090 0.676881
C 0.297194 -0.220028 0.214793
C 1.778094 -0.125196 -0.218895
C -0.470358 0.302356 -1.027309
C 1.798931 1.114849 -1.153200
C 2.293497 2.424081 -0.511590
C -2.895749 0.237134 -0.247425
C -2.227330 2.225547 -1.042199
C -3.958177 1.156806 -0.247716
C 0.326203 -2.227552 1.662423
C 3.451342 -1.628617 -1.188300
C -5.271189 0.743141 0.234473
C -4.190745 -1.563584 0.714532
C -0.347833 -3.562080 1.852654
C 4.423305 1.960779 0.633151
C 3.639272 -2.949301 -1.893556
C 5.911432 1.903821 0.418888
H 0.138029 0.437141 1.089564
H 2.471469 -0.033849 0.629778
H -0.597403 -0.529165 -1.751985
H 2.395811 0.907810 -2.058308
H 1.921800 2.553240 0.520333
H 1.986334 3.272997 -1.141257
H -1.553764 2.962866 -1.465093
H -2.145030 -1.667335 0.252954
H -6.141258 -0.989274 1.043811
H -0.180110 -4.201850 0.968541
H -1.441572 -3.442070 1.965295
H 0.058814 -4.053934 2.747407
H 2.760199 -3.204561 -2.503954
H 3.779432 -3.745857 -1.139649
H 4.545933 -2.911938 -2.516701
H 6.432251 1.959980 1.386266
H 6.144078 0.931632 -0.053564
H 6.251090 2.705666 -0.254255


