%chk=000186652.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186652

0 1
Cl -2.161603 0.951312 -2.502464
N 0.949315 -2.051743 0.023559
C 0.288241 0.301940 0.097401
C 1.280305 -0.746542 0.045858
C -1.061025 -0.059523 0.124478
C 2.705438 -0.383697 0.020234
C 3.083252 0.979339 0.042747
C -1.426585 -1.432847 0.097701
C 2.047698 2.016578 0.088595
C 0.732837 1.680302 0.115045
C -0.378284 -2.404485 0.046121
C -2.119155 0.974272 0.198489
C 3.700986 -1.387052 -0.027179
C 4.459784 1.304324 0.018630
C -2.787104 -1.893970 0.115749
C 2.459470 3.454094 0.103645
C -0.707395 -3.808518 0.018316
C 5.044583 -1.045671 -0.050390
C 5.424775 0.308819 -0.027033
C -2.695828 1.507238 -0.963888
C -2.567544 1.440114 1.444363
C -3.069115 -3.231330 0.087685
C -2.014880 -4.201436 0.039067
C -3.696164 2.480876 -0.907223
C -3.567657 2.413402 1.513287
C -4.130779 2.932636 0.341881
H -0.041570 2.449047 0.143956
H 3.395751 -2.437969 -0.045853
H 4.769410 2.348087 0.035370
H -3.585092 -1.151164 0.147620
H 1.600867 4.138505 0.138505
H 3.085046 3.682342 0.978689
H 3.034806 3.713111 -0.797452
H 0.115903 -4.523192 -0.020888
H 5.808173 -1.820731 -0.087128
H 6.481852 0.570482 -0.045569
H -2.128503 1.036384 2.357777
H -4.098157 -3.587580 0.099136
H -2.283799 -5.257201 0.017484
H -4.128753 2.879597 -1.824915
H -3.910203 2.769174 2.484498
H -4.910598 3.691376 0.401398


%chk=000186652-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186652

0 1
Cl -2.147611 1.079753 -2.629597
N 0.970020 -2.084865 0.037457
C 0.298584 0.294554 0.083372
C 1.295662 -0.765404 0.048361
C -1.074848 -0.066284 0.105439
C 2.717116 -0.399268 0.025073
C 3.103298 0.985968 0.034506
C -1.432318 -1.451401 0.092800
C 2.076679 2.030506 0.067467
C 0.740530 1.672652 0.090953
C -0.359428 -2.435021 0.057844
C -2.142201 0.985315 0.176396
C 3.718889 -1.410018 -0.007814
C 4.495173 1.305309 0.010133
C -2.792818 -1.915398 0.107573
C 2.478184 3.492304 0.071964
C -0.689561 -3.832160 0.044539
C 5.080127 -1.071181 -0.031007
C 5.470308 0.296356 -0.022023
C -2.716254 1.584878 -0.970091
C -2.626625 1.416737 1.441428
C -3.079422 -3.279264 0.092098
C -2.019824 -4.247191 0.061413
C -3.722705 2.568440 -0.890146
C -3.633155 2.400613 1.549248
C -4.182692 2.978041 0.381395
H -0.023741 2.457092 0.113039
H 3.387194 -2.452024 -0.015043
H 4.808505 2.353967 0.015756
H -3.605148 -1.181180 0.127659
H 1.589716 4.144225 0.099019
H 3.106865 3.739884 0.948782
H 3.063145 3.755972 -0.830011
H 0.140919 -4.544311 0.018881
H 5.842222 -1.857635 -0.056671
H 6.533215 0.562244 -0.040834
H -2.197689 0.964984 2.342450
H -4.120556 -3.620359 0.100756
H -2.264270 -5.315121 0.049541
H -4.136156 3.002113 -1.805321
H -3.986093 2.713370 2.537429
H -4.964537 3.741508 0.453090


