%chk=000251847.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251847

0 1
O -1.223862 1.474766 -0.735657
O 1.976486 1.752510 0.426589
O 4.973440 0.267661 -0.251231
C -6.399755 -0.776334 0.054504
C -5.008510 -0.155939 -0.082367
C -6.937535 -0.691894 1.496565
C -6.307225 -2.260026 -0.357126
C -7.388671 -0.034186 -0.868860
C -4.233952 0.203929 1.023909
C -4.469088 0.036945 -1.372793
C -2.954418 0.757479 0.874671
C -3.205548 0.581931 -1.555567
C -2.455829 0.941307 -0.416284
C -0.352543 1.882792 0.359912
C 0.913969 2.332867 -0.368666
C 3.286036 1.877524 -0.178751
C 4.168034 1.006068 0.715557
C 5.847955 -0.684606 0.225564
C 6.040472 -1.006369 1.573715
C 6.562696 -1.328007 -0.807053
C 6.975520 -2.000650 1.888260
C 7.483778 -2.310439 -0.461257
C 7.694706 -2.650295 0.884554
H -7.001712 0.345694 1.840518
H -6.307319 -1.245986 2.199598
H -7.944022 -1.118718 1.565370
H -5.592396 -2.800607 0.272673
H -5.975019 -2.373608 -1.393740
H -7.275681 -2.760870 -0.265859
H -7.401415 1.039000 -0.650189
H -8.408728 -0.410474 -0.743302
H -7.129998 -0.150830 -1.925839
H -4.611182 0.057876 2.036575
H -5.054553 -0.247311 -2.248768
H -2.381051 1.025316 1.754405
H -2.783688 0.734065 -2.545437
H -0.148840 1.014375 1.016296
H -0.844616 2.692011 0.922011
H 1.037731 3.427797 -0.384943
H 0.941435 1.930595 -1.400919
H 3.581114 2.939419 -0.174210
H 3.269823 1.490949 -1.217308
H 4.840755 1.586568 1.366170
H 3.558123 0.297687 1.309591
H 5.488451 -0.513514 2.365141
H 6.380150 -1.048197 -1.841058
H 7.138832 -2.266066 2.932842
H 8.046973 -2.821758 -1.242090
H 8.417575 -3.420045 1.140587


%chk=000251847-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251847

0 1
O -1.494599 0.525334 -1.258050
O 1.977283 0.061892 -0.204743
O 5.631873 0.076348 -0.337076
C -7.065548 -0.079295 0.290244
C -5.566290 0.059038 -0.064989
C -7.283965 -0.645230 1.717071
C -7.752628 -1.041718 -0.725468
C -7.747944 1.320166 0.213290
C -4.524491 -0.294751 0.824547
C -5.182477 0.564123 -1.341350
C -3.158572 -0.159304 0.476301
C -3.834179 0.707949 -1.709120
C -2.812649 0.344852 -0.797508
C -0.405132 0.154517 -0.346585
C 0.887399 0.449075 -1.105277
C 3.298130 0.293423 -0.795398
C 4.309014 -0.165812 0.253651
C 6.761033 -0.257340 0.432103
C 6.703854 -0.816877 1.732724
C 8.010817 0.004321 -0.182715
C 7.910851 -1.110733 2.410240
C 9.202606 -0.294107 0.506139
C 9.161389 -0.853968 1.807457
H -6.843817 0.011838 2.490053
H -6.848722 -1.655770 1.828783
H -8.367356 -0.723713 1.922208
H -7.297840 -2.048316 -0.681281
H -7.658835 -0.674328 -1.763156
H -8.830808 -1.136585 -0.495371
H -7.289983 2.019688 0.936432
H -8.826243 1.234927 0.446645
H -7.653969 1.765872 -0.793277
H -4.763407 -0.686608 1.817757
H -5.951650 0.852629 -2.067362
H -2.390477 -0.447518 1.200610
H -3.549475 1.096748 -2.691891
H -0.460558 -0.921125 -0.086433
H -0.451182 0.754102 0.584057
H 0.949395 1.528131 -1.359748
H 0.924381 -0.139094 -2.046330
H 3.444977 1.369285 -1.027725
H 3.420952 -0.290514 -1.731857
H 4.184539 0.416571 1.187906
H 4.170264 -1.242100 0.476529
H 5.746313 -1.024413 2.219529
H 8.022342 0.436461 -1.188193
H 7.866070 -1.543142 3.416310
H 10.166406 -0.089617 0.026615
H 10.089807 -1.084909 2.340003


