%chk=000132098.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132098

0 1
 O    2.510000      -1.020600       2.056200    
 O    6.389300      0.5939000      0.2359000    
 O   -5.040800       1.540300       1.294600    
 O   -4.893700       2.015900     -0.9210000    
 N    4.390700     -0.1353000     -0.7295000    
 N    4.580700     -0.1606000       1.485100    
 C    1.944500      0.2220000     -0.8236000    
 C    3.105500     -0.6513000     -0.2978000    
 C   0.8540000     -0.7757000      -1.262200    
 C    2.853600      -2.072700     -0.8216000    
 C    1.685300      -1.944100      -1.796400    
 C    1.474300       1.347100      9.0099998E-02
 C  -0.1121000      -1.222200     -0.1668000    
 C    3.322500     -0.6456000       1.222000    
 C   0.3709000       2.173300     -0.5684000    
 C   -1.343700      -1.905500     -0.7565000    
 C    5.252500      0.1514000      0.3271000    
 C  -7.0900001E-02   3.322900      0.3395000    
 C   -2.293700      -2.380200      0.3455000    
 C   -1.183600       4.184600     -0.2652000    
 C   -3.509800      -3.098900     -0.2432000    
 C   -2.480800       3.449200     -0.6141000    
 C   -4.481700      -3.615800      0.8196000    
 C   -3.175000       2.831500      0.5991000    
 C   -5.704800      -4.308400      0.2389000    
 C   -4.443300       2.104900      0.2126000    
 H    2.298100      0.7019000      -1.750700    
 H   0.2755000     -0.3375000      -2.085600    
 H    3.726100      -2.506300      -1.323100    
 H    2.577100      -2.755400     -9.4999997E-03
 H    1.133100      -2.882600      -1.892500    
 H    2.073100      -1.691100      -2.791600    
 H    2.325500       2.004200      0.3101000    
 H    1.123400      0.9686000       1.055600    
 H   0.3815000      -1.899800      0.5391000    
 H  -0.4698000     -0.3734000      0.4224000    
 H    4.644600     -1.5000000E-03  -1.703500    
 H   0.7307000       2.581900      -1.520400    
 H  -0.4895000       1.539600     -0.7963000    
 H   -1.872800      -1.207500      -1.417100    
 H   -1.048100      -2.765200      -1.367600    
 H    4.968600     -5.5700000E-02   2.415700    
 H   0.7914000       3.970100      0.5434000    
 H  -0.3935000       2.928100       1.309700    
 H   -1.762800      -3.059500       1.023300    
 H   -2.627700      -1.522300      0.9416000    
 H  -0.8022000       4.660900      -1.177100    
 H   -1.412500       4.998500      0.4340000    
 H   -4.043300      -2.413900     -0.9140000    
 H   -3.171200      -3.943000     -0.8569000    
 H   -3.164600       4.168700      -1.083400    
 H   -2.293200       2.683700      -1.375600    
 H   -3.957700      -4.316600       1.480300    
 H   -4.814200      -2.778400       1.444500    
 H   -3.432400       3.614400       1.320400    
 H   -2.517500       2.100400       1.080500    
 H   -6.275300      -3.624100     -0.3969000    
 H   -6.362100      -4.656500       1.041700    
 H   -5.413200      -5.174500     -0.3635000    
 H   -5.862300       1.063000       1.050700    


%chk=000132098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132098

0 1
O 2.480371 -1.162993 2.017499
O 6.435356 0.761540 0.323144
O -4.708237 0.817352 0.847889
O -5.107387 2.269911 -0.917881
N 4.469643 -0.080078 -0.736127
N 4.547145 -0.134069 1.494931
C 1.956899 0.246208 -0.872235
C 3.158530 -0.650927 -0.353192
C 0.851572 -0.755685 -1.344089
C 2.869416 -2.083510 -0.927459
C 1.708142 -1.907233 -1.939638
C 1.524165 1.381472 0.080747
C -0.124259 -1.218814 -0.231935
C 3.305177 -0.695040 1.194234
C 0.456317 2.313744 -0.538086
C -1.297031 -2.082493 -0.752324
C 5.291524 0.247795 0.330109
C -0.068724 3.364298 0.466810
C -2.374724 -2.322875 0.329569
C -1.215501 4.253572 -0.079349
C -3.567879 -3.173404 -0.161132
C -2.466767 3.487879 -0.579039
C -4.661054 -3.357876 0.916294
C -3.082745 2.561653 0.489749
C -5.862389 -4.193969 0.424966
C -4.378076 1.918184 0.034508
H 2.352573 0.723373 -1.796993
H 0.248306 -0.278851 -2.143247
H 3.781270 -2.521606 -1.368732
H 2.548787 -2.737669 -0.097411
H 1.137496 -2.840948 -2.081701
H 2.102351 -1.608772 -2.931231
H 2.413561 1.984907 0.358791
H 1.130862 0.949203 1.020604
H 0.423248 -1.755493 0.567034
H -0.557141 -0.322807 0.257770
H 4.748650 0.109902 -1.696641
H 0.873559 2.827066 -1.429557
H -0.388489 1.698157 -0.903151
H -1.765439 -1.580378 -1.626039
H -0.923790 -3.060468 -1.119924
H 4.925000 -0.031168 2.436882
H 0.770258 4.017175 0.782415
H -0.405745 2.843098 1.386407
H -1.908598 -2.814834 1.208579
H -2.754472 -1.342846 0.687385
H -0.829804 4.869508 -0.916740
H -1.520895 4.965258 0.715087
H -4.016438 -2.696066 -1.058204
H -3.205668 -4.170415 -0.489188
H -3.234176 4.212874 -0.907799
H -2.216015 2.890276 -1.475647
H -4.213585 -3.840034 1.809174
H -5.009743 -2.358670 1.251269
H -3.303388 3.133222 1.415001
H -2.390736 1.755400 0.793429
H -6.346690 -3.719793 -0.450096
H -6.628218 -4.309683 1.214130
H -5.539475 -5.206674 0.117647
H -5.574203 0.432411 0.540333


