%chk=000283572.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283572

0 1
O 4.747956 0.295250 1.313904
O 2.858659 -2.354006 -0.110649
O 6.087203 -2.249209 -0.545839
O 6.759125 1.480148 -1.393477
O -3.161125 0.300478 -0.080474
N 2.453074 0.189296 0.676063
N 2.562988 1.353930 -0.070717
N 1.399216 1.725004 -0.466758
N 0.637169 -1.296039 1.446700
N -1.367345 1.772567 -1.415690
N -1.829750 0.134095 0.319572
C 4.015793 -1.801239 0.506087
C 5.055980 -1.261475 -0.508282
C 3.593454 -0.530077 1.307810
C 5.571665 0.053444 0.126063
C 5.481706 1.288784 -0.777029
C 1.091058 -0.203831 0.705592
C 0.420696 0.802110 -0.033844
C -1.000033 0.924003 -0.350387
C -4.014132 -0.179762 1.021494
C -5.400462 -0.165640 0.441864
C -6.494066 0.144883 1.263518
C -5.606549 -0.480808 -0.908923
C -7.787072 0.131389 0.733445
C -6.901084 -0.484802 -1.434503
C -7.992701 -0.181941 -0.614277
H 4.476261 -2.569570 1.171409
H 4.629690 -1.126223 -1.524727
H 3.351782 -0.711308 2.385098
H 6.596466 -0.070545 0.545572
H 5.165902 2.179810 -0.199688
H 4.787839 1.167378 -1.631636
H 3.115234 -3.103587 -0.698160
H 6.775141 -2.000141 -1.204985
H 7.352528 1.991518 -0.805891
H -0.378653 -1.432497 1.386954
H 1.144305 -2.165152 1.267276
H -2.334063 2.079113 -1.421863
H -0.709253 2.497762 -1.675268
H -3.886184 0.503925 1.878132
H -3.697439 -1.199525 1.308482
H -6.340930 0.396105 2.311005
H -4.747924 -0.712950 -1.542130
H -8.636263 0.368547 1.371991
H -7.058753 -0.725809 -2.484450
H -9.000609 -0.188804 -1.023983


%chk=000283572-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000283572

0 1
O 4.721465 0.485987 1.410460
O 3.003111 -2.518738 0.229827
O 5.877805 -2.044455 -0.994345
O 6.752062 0.835476 -1.753662
O -3.195874 0.359368 0.003686
N 2.438949 0.222031 0.632795
N 2.602290 1.399106 -0.193794
N 1.358872 1.755323 -0.551980
N 0.607237 -1.205768 1.412397
N -1.457348 1.995999 -1.053337
N -1.784335 0.080622 0.381137
C 4.104319 -1.667992 0.653242
C 4.955586 -1.049072 -0.465273
C 3.569250 -0.399489 1.361264
C 5.643517 0.127001 0.275694
C 5.897315 1.328728 -0.639445
C 1.108607 -0.127011 0.724181
C 0.427887 0.869061 -0.017559
C -1.010181 0.983558 -0.237446
C -4.053876 -0.545537 0.798404
C -5.476210 -0.374039 0.311183
C -6.469774 0.179067 1.155209
C -5.832920 -0.770818 -1.003760
C -7.801022 0.325167 0.700672
C -7.159048 -0.619601 -1.463231
C -8.148232 -0.073558 -0.610235
H 4.775787 -2.210259 1.350968
H 4.294971 -0.656735 -1.265018
H 3.233972 -0.585300 2.396778
H 6.588936 -0.230768 0.730341
H 6.377808 2.164428 -0.097568
H 4.952199 1.676507 -1.081408
H 3.353528 -3.212972 -0.382430
H 6.399856 -1.591376 -1.707921
H 7.703855 0.971060 -1.520505
H -0.419432 -1.260345 1.384055
H 1.159409 -2.067024 1.410819
H -2.457008 2.103118 -1.203442
H -0.778170 2.636075 -1.459364
H -3.958477 -0.291597 1.872016
H -3.690274 -1.581640 0.646716
H -6.200698 0.498788 2.169285
H -5.064876 -1.191070 -1.663455
H -8.561592 0.751488 1.364407
H -7.423905 -0.928336 -2.480843
H -9.178840 0.040141 -0.965114


