%chk=000250999.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250999

0 1
O 0.905377 2.016077 -0.807337
O -0.394376 5.007699 -1.379714
O -2.331938 1.515509 -1.075391
O 0.824002 0.037379 -1.959461
O -1.499550 0.169518 0.588927
O 5.700579 -4.719612 1.358619
O 4.739588 -5.453578 -0.435332
O -5.061046 -6.498101 0.087787
O -3.651708 -6.301316 1.717234
N 2.193319 0.345974 -0.055634
N -3.142331 -0.564267 -0.944545
N 4.938854 -4.598113 0.411888
N -4.239523 -5.870702 0.738160
C -0.212156 2.550007 -1.602937
C 0.283548 3.930895 -2.056237
C -1.432350 2.591883 -0.684459
C 0.057004 5.419173 -0.131861
C 1.256950 0.691976 -1.039911
C 2.846056 -0.915689 0.031170
C -2.232466 0.329765 -0.358715
C -3.378443 -1.891928 -0.492048
C -0.570530 6.604860 0.295502
C 1.000044 4.747304 0.648718
C 3.736882 -1.105379 1.114124
C 2.637041 -1.935665 -0.917887
C -2.715260 -2.433058 0.627163
C -4.323391 -2.658920 -1.214359
C 4.211035 -3.325346 0.282730
C -0.226858 7.117882 1.543212
C 1.327467 5.290071 1.897443
C 4.416113 -2.310807 1.235289
C 3.320562 -3.138883 -0.789766
C -3.939242 -4.495105 0.310491
C 0.721412 6.465102 2.345569
C -2.997372 -3.733961 1.025892
C -4.599619 -3.958411 -0.809681
H -0.389256 1.869833 -2.475834
H 1.381380 4.022412 -1.945959
H -0.004323 4.134728 -3.109571
H -2.062300 3.492444 -0.852272
H -1.155468 2.507571 0.386225
H 2.377406 1.036004 0.683412
H -1.297767 7.095356 -0.347049
H 1.466614 3.824834 0.309798
H -3.663910 -0.235290 -1.767100
H 3.894965 -0.321493 1.853431
H 1.939010 -1.789104 -1.751947
H -1.980351 -1.837204 1.183067
H -4.834843 -2.244869 -2.082191
H -0.697127 8.035578 1.898225
H 2.062805 4.785078 2.523789
H 5.112320 -2.482226 2.065948
H 3.173120 -3.946748 -1.518068
H -2.492764 -4.174976 1.895115
H -5.328117 -4.573112 -1.353238
H 0.982627 6.877953 3.317472


%chk=000250999-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250999

0 1
O -0.050240 1.500627 -0.977447
O -0.427170 4.510937 -0.867325
O -2.754909 0.965939 -1.897644
O 1.769547 1.119582 -2.424121
O -3.093390 0.612317 0.416075
O 6.685653 -3.213373 1.674902
O 7.348257 -2.703312 -0.449768
O -5.873669 -6.573191 0.948479
O -5.690817 -5.433218 2.918461
N 1.649855 0.239897 -0.218116
N -3.538496 -1.036100 -1.232318
N 6.500992 -2.649645 0.525444
N -5.565218 -5.520597 1.634578
C -0.720593 2.323782 -2.019102
C -0.139363 3.747389 -2.083511
C -2.201317 2.312732 -1.638848
C 0.544083 4.619547 0.156707
C 1.198693 0.956251 -1.317065
C 2.866795 -0.466268 -0.085987
C -3.126477 0.208290 -0.767388
C -4.035488 -2.119567 -0.474075
C 0.116703 5.361174 1.284870
C 1.852366 4.080966 0.106993
C 3.117282 -1.106992 1.161182
C 3.824982 -0.553971 -1.135153
C -4.191218 -2.064716 0.940124
C -4.388713 -3.304538 -1.181863
C 5.247060 -1.898860 0.315349
C 0.998911 5.561657 2.365157
C 2.727588 4.296253 1.198141
C 4.304740 -1.823977 1.366276
C 5.015127 -1.271470 -0.928659
C -5.038117 -4.349387 0.907110
C 2.311653 5.031214 2.329608
C -4.693698 -3.183215 1.625886
C -4.889823 -4.420514 -0.496822
H -0.561648 1.840375 -3.003198
H 0.937467 3.713472 -2.319203
H -0.650846 4.294572 -2.896467
H -2.765157 3.006968 -2.283201
H -2.341365 2.577345 -0.577980
H 1.023863 0.267135 0.591804
H -0.899022 5.768221 1.293089
H 2.212783 3.509938 -0.753977
H -3.474871 -1.156227 -2.246267
H 2.379037 -1.039265 1.968645
H 3.627346 -0.063884 -2.089940
H -3.920737 -1.154738 1.478348
H -4.269132 -3.346720 -2.270917
H 0.660804 6.135449 3.234998
H 3.741363 3.882498 1.154581
H 4.516804 -2.322611 2.315271
H 5.768419 -1.353857 -1.716507
H -4.824893 -3.167361 2.711031
H -5.166785 -5.338645 -1.020795
H 2.996692 5.190695 3.168452


