%chk=000186385.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186385

0 1
O 1.052707 -0.922088 1.764428
O 1.977144 -0.086474 -0.172755
O 1.308101 2.402363 1.800448
O -3.851894 2.504932 1.209041
O 3.709379 -1.510529 0.109284
O -0.233467 -1.413612 -2.261211
N -0.734630 0.378784 -0.312677
N -2.348702 -0.631142 -1.853452
N -3.083214 0.956482 -0.299342
C 1.816113 0.139388 1.249705
C -0.507767 1.270881 0.751128
C 0.895654 1.391536 1.296821
C -2.062118 0.270503 -0.780418
C -1.514871 2.010375 1.276802
C -2.906851 1.890100 0.779014
C 1.795331 -1.948195 2.489923
C 2.964910 -0.948719 -0.652454
C -1.417828 -1.437923 -2.547946
C 2.165310 -1.447945 3.850590
C 2.871766 -0.985119 -2.128806
C -2.017676 -2.283890 -3.623798
C 3.152787 -1.970164 4.572550
H 2.802416 0.280373 1.734300
H 0.042552 -0.213788 -0.688613
H -1.351851 2.729769 2.082543
H 1.036238 -2.756659 2.534693
H 2.661384 -2.273652 1.878405
H -3.349969 -0.650780 -2.115725
H 1.542106 -0.627347 4.215339
H 3.658436 -1.619737 -2.564962
H 2.949192 0.019652 -2.575258
H 1.887960 -1.385549 -2.458177
H -1.236583 -2.893386 -4.112689
H -2.496485 -1.687958 -4.416654
H -2.772658 -2.988375 -3.240315
H 3.405116 -1.622143 5.565848
H 3.786263 -2.780364 4.236693


%chk=000186385-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186385

0 1
O 0.798885 -1.101070 1.924188
O 1.839201 -0.201728 -0.066956
O 1.061233 2.198458 2.225281
O -3.885799 2.904506 0.829160
O 3.771048 -1.442833 0.370946
O -0.234961 -1.529694 -2.122260
N -0.864003 0.347447 -0.255148
N -2.342132 -0.556029 -1.914333
N -3.121656 1.144488 -0.536156
C 1.574565 -0.022980 1.403513
C -0.627927 1.253484 0.786628
C 0.695604 1.238768 1.500299
C -2.107033 0.355242 -0.854901
C -1.627999 2.125397 1.168560
C -2.952207 2.114681 0.507501
C 1.571689 -2.195191 2.627048
C 2.988640 -0.936428 -0.458733
C -1.442768 -1.440167 -2.508362
C 2.283609 -1.682506 3.852344
C 3.071493 -0.998413 -1.961413
C -2.018385 -2.271585 -3.642223
C 3.636077 -1.670738 3.971869
H 2.534881 0.118960 1.930839
H -0.125027 -0.287571 -0.613474
H -1.447997 2.832794 1.981233
H 0.772093 -2.909687 2.881998
H 2.278969 -2.649337 1.912647
H -3.302593 -0.486845 -2.264925
H 1.647910 -1.299143 4.662566
H 3.927837 -1.618256 -2.262514
H 3.185067 0.018861 -2.376080
H 2.128798 -1.411926 -2.360997
H -1.236791 -2.942881 -4.024704
H -2.371807 -1.626746 -4.467459
H -2.874226 -2.878792 -3.295601
H 4.127137 -1.303244 4.879923
H 4.282878 -2.029695 3.162000


