%chk=000144764.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144764

0 1
 O    3.880900      -1.644400     -0.9392000    
 O    3.778000      -1.865100       1.388400    
 O   -8.407700     -0.5102000      0.7447000    
 N   -1.613500     -0.6461000     -0.9115000    
 N   -2.049100     -0.6759000      0.2636000    
 C    7.288900       1.354000       1.451700    
 C    6.853800       2.236900      0.2774000    
 C    6.540900      1.9800000E-02   1.512200    
 C    5.387300       2.667300      0.3592000    
 C    6.687000     -0.8189000      0.2363000    
 C    5.017700       3.605400     -0.7902000    
 C    5.883500      -2.116500      0.2261000    
 C    3.571700       4.064600     -0.6889000    
 C    4.399700      -1.856400      0.3334000    
 C    2.506900      -1.395000     -0.9322000    
 C    1.605000      -2.453900      -1.038000    
 C    2.036500     -8.6700000E-02 -0.8193000    
 C   0.2327000      -2.204400      -1.030800    
 C   0.6642000      0.1628000     -0.8121000    
 C  -0.2378000     -0.8961000     -0.9178000    
 C   -6.176500      7.4100003E-02  0.2843000    
 C   -8.150100       1.662600     -0.2638000    
 C   -7.607300      0.3336000      0.2914000    
 C   -3.431800     -0.4244000      0.2704000    
 C   -5.370600      0.6358000     -0.7060000    
 C   -5.610000     -0.7369000       1.267600    
 C   -3.998300      0.3867000     -0.7130000    
 C   -4.237600     -0.9861000       1.260700    
 C   -9.444200       2.113400      0.3955000    
 H    7.139900       1.893200       2.394800    
 H    8.364800       1.159300       1.365700    
 H    7.061700       1.755500     -0.6833000    
 H    7.480100       3.138600      0.2949000    
 H    6.928000     -0.5583000       2.360500    
 H    5.484900      0.2071000       1.731400    
 H    4.732900       1.790300      0.3216000    
 H    5.205200       3.168500       1.317500    
 H    6.366900     -0.2377000     -0.6344000    
 H    7.746500      -1.058700      8.6099997E-02
 H    5.168700       3.096300      -1.749200    
 H    5.673800       4.483500     -0.7813000    
 H    6.177500      -2.760000       1.063300    
 H    6.082600      -2.689400     -0.6869000    
 H    2.883600       3.215100     -0.7279000    
 H    3.328800       4.735400      -1.519000    
 H    3.396700       4.605500      0.2466000    
 H    1.965600      -3.475000      -1.127000    
 H    2.734700      0.7406000     -0.7393000    
 H  -0.4620000      -3.036100      -1.114800    
 H   0.3077000       1.185900     -0.7253000    
 H   -7.401600       2.447300     -0.1079000    
 H   -8.306800       1.539000      -1.340800    
 H   -5.785800       1.263000      -1.489900    
 H   -6.221000      -1.180000       2.049900    
 H   -3.404100      0.8583000      -1.491700    
 H   -3.804200      -1.618500       2.031100    
 H   -10.24710       1.390500      0.2185000    
 H   -9.315700       2.212000       1.478300    
 H   -9.760900       3.080900     -5.5000000E-03


%chk=000144764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000144764

0 1
O 4.105726 -1.169612 -1.278891
O 4.523816 -3.314672 -0.392967
O -8.110921 2.632578 -0.620363
N -1.456593 -0.480427 -0.510231
N -1.970455 0.657292 -0.910874
C 7.475886 0.680726 1.445442
C 6.727230 1.983756 1.063285
C 6.898888 -0.618414 0.828678
C 5.230384 2.000730 1.451561
C 6.901377 -0.625429 -0.716378
C 4.547386 3.356286 1.157258
C 6.370706 -1.953599 -1.319825
C 3.045368 3.364166 1.515646
C 4.938506 -2.268403 -0.927626
C 2.706564 -1.084561 -1.044637
C 1.900070 -2.089973 -0.455956
C 2.150486 0.152055 -1.468361
C 0.523133 -1.831941 -0.302263
C 0.780854 0.395598 -1.310567
C -0.050351 -0.604000 -0.722489
C -6.167269 1.233081 -0.378075
C -8.542318 0.455621 0.391872
C -7.637456 1.523992 -0.231592
C -3.381813 0.774253 -0.697200
C -5.580236 0.005989 0.048877
C -5.336620 2.225745 -0.966950
C -4.204875 -0.226986 -0.105625
C -3.959545 2.000503 -1.125581
C -10.014432 0.889356 0.487926
H 7.470282 0.577824 2.549865
H 8.540366 0.777625 1.146495
H 6.821883 2.170645 -0.026153
H 7.234178 2.836278 1.560767
H 7.489329 -1.482730 1.195784
H 5.865248 -0.774897 1.197006
H 4.686746 1.202061 0.906551
H 5.127412 1.765800 2.531939
H 6.288023 0.207649 -1.103360
H 7.934280 -0.467696 -1.085393
H 4.674365 3.601603 0.082470
H 5.069376 4.156834 1.720536
H 6.985946 -2.809850 -0.993793
H 6.417058 -1.898324 -2.425012
H 2.495726 2.595506 0.939296
H 2.581251 4.344634 1.301797
H 2.894039 3.145693 2.589693
H 2.335993 -3.034458 -0.131963
H 2.815416 0.896492 -1.916934
H -0.135379 -2.582249 0.147029
H 0.328313 1.338609 -1.630041
H -8.449441 -0.473413 -0.207917
H -8.145417 0.201682 1.396458
H -6.203446 -0.770395 0.504570
H -5.803319 3.162021 -1.289301
H -3.741380 -1.163619 0.217457
H -3.303627 2.751789 -1.576912
H -10.117471 1.800148 1.101983
H -10.421509 1.125330 -0.509936
H -10.626135 0.087795 0.939022


