%chk=000292557.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292557

0 1
O -0.566900 3.110942 -2.261488
O -1.610815 2.337762 2.511729
O -1.773219 4.133707 0.225811
N -0.067441 -2.179734 0.466066
N 2.012303 -0.991789 0.471071
C 0.667182 -1.048161 -0.196620
C 0.570918 -2.466990 1.789202
C 1.849978 -1.605205 1.827659
C 0.019886 0.329031 -0.042488
C -1.473679 -2.321556 0.320533
C 3.131590 -1.395957 -0.337682
C -0.494835 0.763746 1.183145
C -0.022593 1.158949 -1.164592
C -2.210163 -3.109105 1.233953
C 4.118885 -2.289401 0.119013
C -2.126748 -1.785411 -0.813745
C 3.289096 -0.769858 -1.594410
C -0.618688 2.433333 -1.073833
C -1.074455 2.036101 1.274030
C -1.178627 2.876937 0.143705
C -3.565313 -3.350577 1.006299
C 5.239253 -2.552918 -0.671101
C -3.480821 -2.040969 -1.018740
C 4.411767 -1.049118 -2.371415
C -4.209960 -2.820889 -0.114350
C 5.390221 -1.941541 -1.918179
C -1.045755 4.480816 -2.304979
C -1.259549 3.638604 3.058763
C -3.225974 4.055178 0.333533
H 0.754535 -1.317749 -1.287541
H 0.805925 -3.553152 1.818171
H -0.094383 -2.241291 2.647579
H 1.752097 -0.761625 2.547427
H 2.736200 -2.195764 2.138806
H -0.456836 0.137986 2.071268
H 0.396351 0.854396 -2.121641
H -1.735968 -3.542596 2.108310
H 4.013991 -2.778310 1.086685
H -1.586963 -1.175842 -1.533161
H 2.554167 -0.047248 -1.944190
H -4.125373 -3.960652 1.714756
H 5.998976 -3.245728 -0.310354
H -3.976632 -1.625452 -1.896012
H 4.529722 -0.562594 -3.339584
H -5.265030 -3.012505 -0.282675
H 6.261850 -2.153984 -2.531077
H -2.136522 4.487265 -2.236288
H -0.695681 4.807491 -3.290812
H -0.600663 5.071821 -1.496468
H -1.929198 3.712309 3.922106
H -1.439348 4.441698 2.334508
H -0.210142 3.613327 3.366145
H -3.641356 3.592376 -0.564858
H -3.510367 5.108194 0.415753
H -3.505199 3.489699 1.229459


%chk=000292557-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292557

0 1
O -1.039480 2.825686 -2.433051
O -0.886504 2.698226 2.519184
O -1.375479 4.194825 0.099761
N -0.608519 -2.256953 0.732156
N 1.580878 -1.636030 0.392016
C 0.216218 -1.381072 -0.126890
C 0.184854 -2.969832 1.748273
C 1.543480 -2.240412 1.730743
C -0.198458 0.102713 -0.055513
C -1.899380 -2.672868 0.374829
C 2.755870 -1.154616 -0.199213
C -0.342872 0.749763 1.193199
C -0.398840 0.836196 -1.243322
C -2.553105 -3.708188 1.110882
C 3.988132 -1.169778 0.523985
C -2.598109 -2.083803 -0.723190
C 2.773516 -0.667888 -1.542281
C -0.766951 2.200949 -1.202785
C -0.694475 2.110998 1.247550
C -0.944610 2.845837 0.051372
C -3.849266 -4.133497 0.755383
C 5.184595 -0.736356 -0.082818
C -3.892039 -2.523021 -1.066364
C 3.976552 -0.234606 -2.132544
C -4.533197 -3.550674 -0.336091
C 5.195865 -0.265400 -1.415510
C -0.347932 4.107290 -2.700797
C -0.014887 3.859852 2.815366
C -2.780994 4.343850 0.556492
H 0.151628 -1.707213 -1.190657
H 0.303951 -4.041797 1.481483
H -0.293629 -2.916453 2.744776
H 1.612763 -1.480895 2.539943
H 2.378821 -2.951299 1.861407
H -0.205082 0.210204 2.134753
H -0.293828 0.367630 -2.228971
H -2.052366 -4.182933 1.960277
H 4.012420 -1.507020 1.564820
H -2.147256 -1.265120 -1.289764
H 1.852578 -0.635174 -2.129815
H -4.325993 -4.930629 1.338023
H 6.114548 -0.760960 0.497448
H -4.405011 -2.050504 -1.912239
H 3.959258 0.128365 -3.166927
H -5.539425 -3.885566 -0.608136
H 6.126993 0.073016 -1.881395
H -0.595995 4.856297 -1.931121
H -0.712621 4.426237 -3.689065
H 0.746525 3.945107 -2.737722
H -0.326171 4.209358 3.811562
H -0.150604 4.656718 2.063168
H 1.044324 3.540485 2.841658
H -3.463250 3.836488 -0.149843
H -2.976354 5.427176 0.560842
H -2.901391 3.925286 1.571874


