%chk=000221039.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221039

0 1
O -1.930867 -1.977290 -0.000122
O 1.931147 1.977313 -0.001103
C -2.907786 0.654622 -0.000682
C 2.908040 -0.654540 -0.000058
C -3.547951 0.037615 -1.273581
C -3.547967 0.038433 1.272608
C 3.548261 -0.038328 -1.273319
C 3.548091 -0.037472 1.272875
C -1.410353 0.323939 -0.000590
C 1.410610 -0.323890 -0.000285
C -5.078412 0.133232 -1.266707
C -5.078426 0.134043 1.265654
C 5.078731 -0.133805 -1.266270
C 5.078561 -0.132955 1.266093
C -5.671855 -0.499412 -0.000327
C 5.672027 0.499720 -0.000261
C -3.148871 2.177951 -0.001152
C 3.149170 -2.177860 0.000487
C -0.933254 -1.009064 -0.000187
C 0.933517 1.009106 -0.000724
C -0.431623 1.322622 -0.000897
C 0.431886 -1.322576 -0.000062
C -1.536027 -3.367387 0.001759
C 1.536341 3.367421 -0.000537
H -3.254073 -1.031444 -1.347306
H -3.138119 0.529573 -2.172707
H -3.138148 0.530972 2.171423
H -3.254093 -1.030578 1.347015
H 3.254296 1.030657 -1.347771
H 3.138540 -0.530911 -2.172155
H 3.254119 1.031563 1.346563
H 3.138251 -0.529453 2.171987
H -5.393276 1.191602 -1.341032
H -5.484452 -0.369713 -2.164192
H -5.484477 -0.368327 2.163455
H -5.393291 1.192463 1.339296
H 5.393694 -1.192196 -1.339881
H 5.484790 0.368590 -2.164054
H 5.484502 0.370041 2.163594
H 5.393513 -1.191298 1.340455
H -6.771217 -0.388492 -0.000369
H -5.469562 -1.587917 0.000022
H 5.469647 1.588209 -0.000641
H 6.771399 0.388888 -0.000150
H -2.725580 2.654877 -0.890120
H -4.224147 2.395892 -0.001175
H -2.725499 2.655435 0.887477
H 2.725763 -2.654768 0.889407
H 2.725941 -2.655379 -0.888190
H 4.224453 -2.395767 0.000667
H -0.734482 2.367760 -0.001280
H 0.734741 -2.367716 0.000195
H -0.972732 -3.605081 0.908493
H -0.972129 -3.607288 -0.904023
H -2.510180 -3.873386 0.002047
H 0.972609 3.606534 -0.906630
H 2.510508 3.873394 -0.000524
H 0.972893 3.605929 0.905889


%chk=000221039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221039

0 1
O -1.914613 -2.075299 0.000321
O 1.914915 2.075212 -0.000904
C -2.943312 0.668934 -0.000574
C 2.943572 -0.668884 0.000060
C -3.620693 0.070517 -1.286267
C -3.620781 0.071493 1.285525
C 3.620970 -0.071233 -1.285978
C 3.620876 -0.070511 1.285815
C -1.435008 0.308430 -0.000392
C 1.435260 -0.308470 -0.000094
C -5.166134 0.170069 -1.275962
C -5.166220 0.171037 1.275035
C 5.166423 -0.170560 -1.275493
C 5.166329 -0.169851 1.275506
C -5.761804 -0.471098 -0.000241
C 5.761914 0.471525 -0.000149
C -3.154695 2.207350 -0.001166
C 3.155079 -2.207281 0.000501
C -0.950462 -1.034343 0.000067
C 0.950722 1.034294 -0.000557
C -0.435790 1.311520 -0.000701
C 0.436053 -1.311566 0.000195
C -1.439328 -3.457119 0.001195
C 1.439686 3.457050 -0.001109
H -3.339541 -0.993877 -1.368099
H -3.209620 0.587928 -2.176380
H -3.209772 0.589578 2.175275
H -3.339638 -0.992840 1.368189
H 3.339674 0.993070 -1.368546
H 3.210036 -0.589295 -2.175777
H 3.339578 0.993839 1.367745
H 3.209868 -0.588067 2.175874
H -5.491739 1.227723 -1.342619
H -5.566114 -0.335237 -2.177437
H -5.566267 -0.333577 2.176868
H -5.491830 1.228743 1.340856
H 5.492179 -1.228213 -1.341427
H 5.566400 0.334206 -2.177271
H 5.566237 0.335421 2.177032
H 5.492075 -1.227467 1.342063
H -6.865460 -0.374518 -0.000313
H -5.530888 -1.556434 0.000176
H 5.530847 1.556828 -0.000458
H 6.865584 0.375097 -0.000083
H -2.714696 2.678721 -0.900226
H -4.229544 2.451228 -0.001260
H -2.714705 2.679419 0.897533
H 2.715113 -2.678774 0.899515
H 2.715124 -2.679294 -0.898244
H 4.229946 -2.451079 0.000571
H -0.758079 2.353344 -0.001074
H 0.758349 -2.353388 0.000525
H -0.839961 -3.681912 0.905438
H -0.839878 -3.683034 -0.902716
H -2.351365 -4.073474 0.001523
H 0.840323 3.682308 -0.905241
H 2.351747 4.073370 -0.001161
H 0.840248 3.682547 0.902913


