%chk=000072164.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072164

0 1
 O   -2.989900      0.3924000      -1.018400    
 N   0.7063000       1.898100      7.1000000E-03
 N  -0.4715000      1.7999999E-02  0.1078000    
 N   -4.270800      -2.923000     -4.2100001E-02
 C    1.621100      0.8831000      7.3000002E-03
 C  -0.5343000       1.329400      6.8700001E-02
 C   0.8704000     -0.2673000      7.0299998E-02
 C   -1.740600       2.124200      8.5900001E-02
 C    3.042500       1.116300     -5.0000001E-02
 C   -2.927900       1.639900     -0.4545000    
 C    1.390700      -1.601100      9.4599999E-02
 C   -3.370300      -1.938900     -0.6417000    
 C   -3.902300     -0.5295000     -0.4366000    
 C   -1.707000       3.397500      0.6544000    
 C   -4.082300       2.417000     -0.4320000    
 C    3.689100       1.190600      -1.284300    
 C    3.773600       1.266900       1.129100    
 C    1.688000      -2.216200       1.313100    
 C    1.603700      -2.293000      -1.100200    
 C   -2.861000       4.180600      0.6797000    
 C   -4.048500       3.690400      0.1364000    
 C    5.064600       1.415400      -1.339500    
 C    5.149100       1.491800       1.073800    
 C   -4.436500      -2.660000       1.387000    
 C   -3.763700      -4.277700     -0.2571000    
 C    2.195300      -3.515400       1.336600    
 C    2.110800      -3.592200      -1.076700    
 C    5.794600       1.566100     -0.1604000    
 C    2.406600      -4.203500      0.1417000    
 H   0.9195000       2.885800     -4.5800000E-02
 H   -3.273800      -2.120600      -1.720000    
 H   -2.355700      -2.017400     -0.2295000    
 H   -4.003500     -0.2880000      0.6267000    
 H   -4.879900     -0.4151000     -0.9197000    
 H  -0.8038000       3.806500       1.100100    
 H   -5.012300       2.052900     -0.8592000    
 H    3.134700       1.074500      -2.212700    
 H    3.285700       1.210800       2.099300    
 H    1.529100      -1.694200       2.253900    
 H    1.378200      -1.831300      -2.058800    
 H   -2.836100       5.170900       1.124800    
 H   -4.946500       4.300900      0.1549000    
 H    5.567500       1.472800      -2.300500    
 H    5.717700       1.608700       1.991800    
 H   -3.479400      -2.530600       1.905400    
 H   -4.961800      -3.493800       1.869300    
 H   -5.072800      -1.789000       1.571500    
 H   -3.661900      -4.485300      -1.328200    
 H   -2.788800      -4.435200      0.2188000    
 H   -4.465500      -5.020200      0.1389000    
 H    2.425700      -3.991500       2.285200    
 H    2.275200      -4.128000      -2.007000    
 H    6.865700       1.741000     -0.2035000    
 H    2.801400      -5.215100      0.1601000    


%chk=000072164-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072164

0 1
O -3.095619 0.529500 -1.038592
N 0.725075 1.939494 0.200594
N -0.439935 0.026944 0.392280
N -4.206453 -3.004141 -0.460285
C 1.688268 0.921927 0.277549
C -0.549247 1.370075 0.258760
C 0.934586 -0.270358 0.411763
C -1.765301 2.195980 0.231098
C 3.122140 1.231047 0.142599
C -2.988439 1.763124 -0.370006
C 1.381123 -1.664293 0.610101
C -3.675198 -1.809463 -1.157765
C -3.503980 -0.629451 -0.192587
C -1.726443 3.504638 0.795893
C -4.110136 2.624475 -0.398012
C 3.990544 0.378353 -0.595307
C 3.662188 2.420561 0.711117
C 2.592560 -1.988104 1.280758
C 0.551437 -2.725371 0.155358
C -2.845638 4.359497 0.763327
C -4.046746 3.918127 0.160772
C 5.353555 0.702618 -0.750986
C 5.025350 2.747146 0.545887
C -3.195874 -3.698964 0.362138
C -4.902146 -3.933805 -1.372373
C 2.970779 -3.334467 1.470215
C 0.929155 -4.070304 0.348096
C 5.879074 1.888859 -0.184711
C 2.144020 -4.383260 1.002636
H 0.929678 2.915051 -0.014277
H -4.397615 -1.507972 -1.938159
H -2.700816 -2.006212 -1.670729
H -2.710217 -0.804624 0.555119
H -4.468037 -0.405810 0.305269
H -0.813643 3.840068 1.303548
H -5.020991 2.261740 -0.885747
H 3.588014 -0.530076 -1.054561
H 3.020757 3.074313 1.315395
H 3.229706 -1.187684 1.671014
H -0.388783 -2.473726 -0.344944
H -2.785788 5.356034 1.213495
H -4.923921 4.573365 0.128343
H 6.004986 0.034372 -1.324997
H 5.422671 3.663739 0.996050
H -2.377484 -4.158757 -0.251737
H -3.680480 -4.504736 0.942229
H -2.729140 -2.999983 1.075505
H -5.714408 -3.404269 -1.901036
H -4.229041 -4.392672 -2.141541
H -5.354340 -4.755179 -0.787156
H 3.905558 -3.565273 1.993774
H 0.276345 -4.874461 -0.011387
H 6.937877 2.139668 -0.310979
H 2.438811 -5.427899 1.152990


