%chk=000240484.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240484

0 1
O 2.320785 -1.067001 1.751363
O 2.583481 2.106860 1.109061
O 4.627067 1.178317 0.878507
O -1.850971 0.280782 0.823923
O -0.759400 -1.192962 -0.500527
C 2.723053 0.148996 -0.281826
C 3.714469 -0.190448 -1.420771
C 3.283581 -1.411541 -2.236449
C 1.410535 0.720769 -0.860120
C 2.394785 -1.120897 0.545238
C 3.122824 -2.641114 -1.336516
C 2.106313 -2.380131 -0.225726
C 3.445568 1.155776 0.624919
C 0.297707 0.919559 0.172793
C -0.768678 -0.130673 0.085045
C 3.109440 3.069388 2.084029
C 3.210102 2.406809 3.440344
C -3.025108 -0.590662 0.877513
C -3.924420 -0.289891 -0.287498
C -5.024744 0.564024 -0.129562
C -3.662543 -0.868814 -1.538493
C -5.864646 0.827339 -1.215946
C -4.503482 -0.601401 -2.620948
C -5.606423 0.244590 -2.460542
H 4.721441 -0.371889 -0.980322
H 3.837332 0.687810 -2.083392
H 2.333440 -1.205035 -2.768531
H 4.034025 -1.614449 -3.025199
H 1.057666 0.049709 -1.675759
H 1.632036 1.694978 -1.343243
H 2.800971 -3.514596 -1.936644
H 4.100569 -2.920119 -0.894519
H 1.071946 -2.296508 -0.650256
H 2.059543 -3.241996 0.472504
H 0.714950 0.941289 1.214641
H -0.157617 1.929590 0.066092
H 4.081107 3.445079 1.717346
H 2.334897 3.855321 2.033812
H 3.440813 3.130806 4.229462
H 4.000504 1.639309 3.451196
H 2.276725 1.894782 3.711710
H -2.692146 -1.646188 0.897318
H -3.456152 -0.308818 1.856613
H -5.225718 1.026752 0.835287
H -2.792760 -1.520695 -1.661021
H -6.720111 1.489050 -1.091615
H -4.299529 -1.052446 -3.590679
H -6.262229 0.450090 -3.304714


%chk=000240484-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240484

0 1
O 2.210263 -1.045082 1.793563
O 2.782368 2.193651 1.073306
O 4.709164 0.894497 1.110364
O -1.894868 0.240116 0.744866
O -0.746406 -1.131641 -0.749159
C 2.803813 0.136858 -0.266860
C 3.798908 -0.200261 -1.432009
C 3.422517 -1.468500 -2.226470
C 1.488019 0.758311 -0.859369
C 2.427943 -1.135061 0.554322
C 3.320632 -2.687650 -1.286410
C 2.245202 -2.443225 -0.199283
C 3.540828 1.086943 0.702830
C 0.298986 0.950701 0.112810
C -0.793389 -0.096462 -0.037491
C 3.393743 3.102425 2.098363
C 3.108215 2.580355 3.508647
C -3.063993 -0.718427 0.722541
C -4.060703 -0.355338 -0.355602
C -5.145854 0.510939 -0.067089
C -3.927212 -0.883839 -1.666161
C -6.080727 0.849325 -1.070673
C -4.861145 -0.546249 -2.670125
C -5.940171 0.320311 -2.374931
H 4.804366 -0.335502 -0.992174
H 3.853302 0.677277 -2.106379
H 2.461270 -1.331489 -2.760054
H 4.193476 -1.644386 -3.000855
H 1.159338 0.118831 -1.698497
H 1.768184 1.738531 -1.283635
H 3.062002 -3.600194 -1.855342
H 4.303874 -2.869259 -0.808993
H 1.246913 -2.389927 -0.682621
H 2.208120 -3.257947 0.544998
H 0.637005 0.943136 1.164565
H -0.169667 1.940695 -0.030970
H 4.478382 3.166433 1.902727
H 2.910331 4.073265 1.903697
H 3.515210 3.287345 4.255498
H 3.581976 1.597399 3.664948
H 2.022998 2.479470 3.681280
H -2.660381 -1.735690 0.582438
H -3.487487 -0.603549 1.732357
H -5.256291 0.920924 0.944446
H -3.083559 -1.546266 -1.889923
H -6.916859 1.517868 -0.837156
H -4.751029 -0.959540 -3.678930
H -6.666612 0.579381 -3.153507


