%chk=000141499.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141499

0 1
 O    5.398200      0.8945000      0.5394000    
 N  -0.7692000     -0.8327000      0.3700000    
 C   -6.982400      0.5722000     -0.4274000    
 C   -6.429000     -0.8231000     -0.1008000    
 C   -8.508600      0.5721000     -0.5118000    
 C   -4.942800     -0.8267000      2.2500001E-02
 C    7.523800      0.2499000     -0.3552000    
 C   -4.149900      -1.064500      -1.100200    
 C   -4.345700     -0.5906000       1.260800    
 C   -9.051500       1.963700     -0.7951000    
 C    8.417900     -0.9146000     -0.7714000    
 C    6.185800     -0.2341000      0.1856000    
 C   -2.169500     -0.8301000      0.2534000    
 C   -2.759800      -1.066200     -0.9844000    
 C   -2.955600     -0.5923000       1.376500    
 C    9.735700     -0.4257000      -1.350900    
 C    4.037800      0.7512000      0.4525000    
 C    1.278500      0.4609000      0.2800000    
 C    3.246900       1.856500      0.1615000    
 C    3.463600     -0.4978000      0.6581000    
 C    1.862300       1.710900      7.5099997E-02
 C    2.079000     -0.6435000      0.5714000    
 C  -0.1654000      0.3100000      0.1902000    
 H   -6.660400       1.285500      0.3422000    
 H   -6.562000      0.9247000      -1.378000    
 H   -6.876800      -1.191200      0.8316000    
 H   -6.739000      -1.535400     -0.8764000    
 H   -8.836700     -0.1122000      -1.302600    
 H   -8.933400      0.2069000      0.4305000    
 H    8.025200      0.8615000      0.4053000    
 H    7.348800      0.9174000      -1.208500    
 H   -4.603000      -1.247700      -2.070900    
 H   -4.952300     -0.4020000       2.142600    
 H   -10.14420       1.939700     -0.8528000    
 H   -8.768500       2.664100     -2.9000000E-03
 H   -8.669200       2.347500      -1.746300    
 H    8.619700      -1.556700      9.3800001E-02
 H    7.905500      -1.530200      -1.519800    
 H    6.343200     -0.8557000       1.074800    
 H    5.705300     -0.8337000     -0.5985000    
 H   -2.149500      -1.252600      -1.864000    
 H   -2.498600     -0.4077000       2.345000    
 H    10.36100      -1.276000      -1.640700    
 H    10.28970      0.1693000     -0.6178000    
 H    9.568800      0.1916000      -2.239300    
 H    3.697900       2.831700      1.4000000E-03
 H    4.048100      -1.375800      0.9154000    
 H    1.251800       2.580900     -0.1527000    
 H    1.650800      -1.627700      0.7420000    
 H  -0.7492000       1.220900     -4.1800000E-02


%chk=000141499-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000141499

0 1
O 5.545647 0.700536 -0.794993
N -0.845731 -0.438594 -0.043773
C -7.317372 0.546132 0.132109
C -6.639892 -0.811591 -0.207522
C -8.860513 0.464742 0.121642
C -5.121547 -0.731585 -0.191180
C 7.841193 0.110754 -0.313362
C -4.394391 -0.361137 -1.352509
C -4.386179 -1.002862 0.993638
C -9.533521 1.813895 0.454101
C 8.825608 -0.862461 0.376799
C 6.382404 -0.283981 -0.076928
C -2.261427 -0.498400 -0.134923
C -2.990351 -0.240340 -1.333012
C -2.981862 -0.905222 1.021640
C 10.299433 -0.461834 0.151916
C 4.155723 0.564737 -0.725808
C 1.314548 0.472815 -0.715112
C 3.412418 1.537059 -1.444016
C 3.480667 -0.456740 -0.001136
C 2.009897 1.486648 -1.435831
C 2.075019 -0.493645 -0.001286
C -0.153254 0.445063 -0.724477
H -6.969166 0.887807 1.127863
H -6.979986 1.312875 -0.594492
H -6.988650 -1.570618 0.520696
H -6.993435 -1.140432 -1.205176
H -9.200750 0.114613 -0.874620
H -9.189860 -0.304748 0.849858
H 8.001102 1.139301 0.062966
H 8.035312 0.133051 -1.402790
H -4.937813 -0.179103 -2.288534
H -4.924027 -1.308984 1.899688
H -10.635949 1.730858 0.441212
H -9.232765 2.170239 1.457414
H -9.244270 2.591982 -0.277330
H 8.613901 -0.894847 1.465122
H 8.659636 -1.890301 -0.005641
H 6.133522 -0.262549 1.004524
H 6.175175 -1.301041 -0.470374
H -2.450667 0.009232 -2.254405
H -2.414154 -1.133839 1.929472
H 10.988872 -1.169027 0.647677
H 10.501278 0.547770 0.555890
H 10.546124 -0.447443 -0.926170
H 3.956433 2.311641 -1.992628
H 4.039501 -1.214139 0.556121
H 1.438873 2.240999 -1.991627
H 1.532658 -1.269043 0.549530
H -0.644316 1.238858 -1.328824


