%chk=000268861.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268861

0 1
O -1.084755 -0.281822 1.278590
O 0.049833 -3.288134 0.241956
O -1.292999 -1.339930 -2.068333
O -3.127356 1.595208 -0.533228
O 2.307595 -3.259445 0.231792
O -2.769996 -2.976017 -2.593517
O 4.250497 3.581647 1.208323
O -2.307424 2.883519 1.142824
N 2.620240 -0.398649 0.725947
N 3.463101 0.638672 0.773427
N 0.380089 2.258812 1.714707
N 2.045672 4.001775 1.718123
C 0.019902 -1.886275 -0.139731
C -1.410428 -1.644466 -0.660238
C 0.165535 -1.006960 1.126576
C -1.919872 -0.395663 0.099581
C 1.291733 -0.043926 1.050340
C -1.858257 0.906881 -0.702867
C 1.343429 1.329641 1.328848
C 2.723133 1.728859 1.137825
C 1.287868 -3.895758 0.371294
C -2.036673 -2.102475 -2.975175
C 3.138612 3.139727 1.338066
C 0.814474 3.593124 1.879618
C 1.093161 -5.328904 0.690762
C -3.237558 2.572095 0.434450
C -1.729150 -1.613534 -4.340728
C -4.618429 3.118510 0.407384
H 0.790818 -1.700695 -0.920180
H -2.065458 -2.539214 -0.513540
H 0.216773 -1.621943 2.060032
H -2.940238 -0.545579 0.526950
H -1.826336 0.743024 -1.799697
H -1.016371 1.552670 -0.391998
H 2.942238 -1.341499 0.485694
H -0.604347 1.970829 1.816509
H 0.021667 4.307772 2.167528
H 1.559466 -5.970620 -0.077558
H 0.027975 -5.612133 0.757142
H 1.568747 -5.588963 1.652558
H -1.375089 -2.438547 -4.982789
H -0.954352 -0.827921 -4.352187
H -2.630939 -1.198159 -4.822590
H -5.252299 2.639339 -0.357274
H -4.607029 4.202162 0.199760
H -5.112807 2.986063 1.384425


%chk=000268861-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268861

0 1
O -1.175641 -0.344533 1.274938
O 0.278176 -3.308091 0.038211
O -1.375655 -1.687653 -2.150697
O -2.884045 1.745539 -0.925500
O 2.577808 -2.987258 0.173220
O -3.582109 -2.449858 -2.086258
O 4.210279 3.612378 1.915422
O -2.449823 2.583327 1.205593
N 2.587507 -0.273800 0.912295
N 3.458404 0.771736 1.128653
N 0.277054 2.257748 2.001166
N 1.925696 4.004464 2.340508
C 0.082771 -1.848928 -0.187424
C -1.363387 -1.684209 -0.676676
C 0.153837 -1.015674 1.134777
C -1.874233 -0.363849 -0.032528
C 1.250008 0.019636 1.175106
C -1.645839 0.915081 -0.871342
C 1.264368 1.361691 1.600549
C 2.638370 1.790124 1.555414
C 1.593465 -3.763813 0.170344
C -2.580794 -2.131266 -2.756987
C 3.031393 3.168646 1.935484
C 0.685971 3.541215 2.341869
C 1.648628 -5.265844 0.277437
C -3.169819 2.549903 0.180463
C -2.432820 -2.145175 -4.257660
C -4.414771 3.370549 -0.052769
H 0.815996 -1.502159 -0.936302
H -1.978348 -2.522559 -0.305909
H 0.222253 -1.706230 1.997912
H -2.949786 -0.445311 0.196943
H -1.456820 0.679063 -1.929145
H -0.814845 1.511913 -0.458340
H 2.933537 -1.190618 0.599041
H -0.727214 2.036756 1.933300
H -0.128834 4.212413 2.638889
H 1.796596 -5.696380 -0.730179
H 0.711730 -5.670274 0.688300
H 2.506862 -5.561453 0.899707
H -3.375062 -2.471099 -4.719924
H -1.617420 -2.828114 -4.552613
H -2.165390 -1.139657 -4.626088
H -5.102155 2.859711 -0.743407
H -4.132004 4.339115 -0.504910
H -4.909500 3.575894 0.908519


