%chk=000256837.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256837

0 1
O 5.058453 2.593346 -0.158817
O 2.921383 2.730647 0.098538
O 6.205107 -3.432890 -0.711373
O 7.317004 -1.575849 -0.714578
N 0.253940 -0.085119 0.227530
N 1.432566 0.622492 0.132771
N 3.960567 2.080286 -0.067116
N 6.282006 -2.217261 -0.637747
C -3.200468 0.660752 0.636252
C -4.648827 0.356963 0.778156
C -2.171198 -0.220281 0.484133
C -2.664997 2.045934 0.657521
C -1.242413 1.979836 0.505443
C -0.875692 0.540313 0.389037
C -5.413765 0.672710 -0.517978
C -2.239182 -1.681619 0.415682
C -6.910727 0.370923 -0.369643
C -3.304342 3.264329 0.795642
C -0.480174 3.133416 0.490720
C -2.520343 4.436817 0.779702
C -1.137884 4.373422 0.630004
C -3.081019 -2.301356 -0.523384
C -1.473157 -2.470042 1.290976
C -7.675224 0.683127 -1.653527
C -3.156081 -3.695126 -0.580999
C -1.556615 -3.862897 1.229236
C -2.397069 -4.477499 0.295097
C 2.608573 -0.075220 -0.058744
C 3.853441 0.633906 -0.155015
C 2.628623 -1.506213 -0.164641
C 5.054439 -0.087260 -0.346064
C 3.801846 -2.186110 -0.350323
C 5.033042 -1.469902 -0.440927
H -5.074770 0.937720 1.624236
H -4.796323 -0.711384 1.051635
H -4.990383 0.083859 -1.355626
H -5.266220 1.734166 -0.797062
H -7.056776 -0.693350 -0.097603
H -7.334550 0.957155 0.469317
H -4.384524 3.326263 0.914368
H 0.608557 3.112325 0.375507
H -3.011256 5.404766 0.887023
H -0.546123 5.289641 0.619515
H -3.668766 -1.693597 -1.210292
H -0.812690 -1.992551 2.013719
H -8.743696 0.465325 -1.540512
H -7.309140 0.088588 -2.498602
H -7.585223 1.739018 -1.933503
H 1.450139 1.678224 0.195810
H -3.806859 -4.172775 -1.311841
H -0.964905 -4.471735 1.911243
H -2.458751 -5.563244 0.249071
H 1.674693 -2.046199 -0.096708
H 6.010385 0.464021 -0.418765
H 3.824272 -3.281509 -0.433291


%chk=000256837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256837

0 1
O 5.179966 2.628129 -0.062089
O 2.921011 2.769735 0.186935
O 6.245947 -3.516573 -0.766439
O 7.429034 -1.561346 -0.709981
N 0.281807 -0.101954 0.227850
N 1.455392 0.609498 0.148375
N 4.022276 2.071444 0.005842
N 6.324397 -2.229798 -0.653203
C -3.196254 0.663798 0.575456
C -4.665932 0.362588 0.699701
C -2.136439 -0.231815 0.460479
C -2.650539 2.042399 0.614308
C -1.220003 1.994738 0.510613
C -0.865751 0.547353 0.399261
C -5.484102 0.682491 -0.588358
C -2.205084 -1.710223 0.412917
C -6.995893 0.425738 -0.399293
C -3.320958 3.270344 0.750970
C -0.469262 3.187281 0.538100
C -2.559230 4.468817 0.779145
C -1.152465 4.427116 0.671690
C -3.156480 -2.371626 -0.413483
C -1.334218 -2.510329 1.206315
C -7.816768 0.737467 -1.669123
C -3.240430 -3.780659 -0.442060
C -1.419888 -3.918133 1.179954
C -2.373463 -4.561646 0.356067
C 2.643860 -0.069242 -0.047064
C 3.911411 0.618968 -0.120610
C 2.649114 -1.495683 -0.185334
C 5.115449 -0.092920 -0.319284
C 3.836025 -2.195956 -0.382015
C 5.067942 -1.485098 -0.446461
H -5.090396 0.963726 1.530622
H -4.815825 -0.699978 0.963793
H -5.105270 0.065706 -1.427874
H -5.320793 1.737400 -0.885173
H -7.153136 -0.631554 -0.104070
H -7.367710 1.042121 0.444712
H -4.411874 3.309196 0.839492
H 0.621600 3.223177 0.470588
H -3.065881 5.434174 0.885628
H -0.574644 5.356766 0.694797
H -3.810316 -1.777090 -1.060701
H -0.601221 -2.021240 1.855128
H -8.893504 0.545210 -1.510315
H -7.484780 0.114002 -2.520436
H -7.703150 1.796982 -1.966171
H 1.538475 1.639944 0.223325
H -3.975554 -4.267640 -1.092593
H -0.746954 -4.514300 1.806669
H -2.437374 -5.655194 0.334933
H 1.686084 -2.007816 -0.136525
H 6.065716 0.444280 -0.371278
H 3.844941 -3.283472 -0.490526


